Isonicotinic Acid

Isonicotinic Acid

SCHEMBL5858849

O=C([O-])c1ccncc1.[Na+]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Isonicotinic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA2 known ✓ P00918 13/20 0.56
▸ CA4 known ✓ P22748 1/20 0.56
▸ CA1 known ✓ P00915 12/20 0.54
▸ ADORA3 known ✓ P0DMS8 1/20 0.48
▸ NAPRT Q6XQN6 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.52
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.48
▸ MPO P05164 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.46
▸ GAA P10253 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Isonicotinic Acid SCHEMBL7540396 0.97 CA2 (0.54) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25273196 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL11323095 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL3705303 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25271513 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25261209 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25269382 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25270921 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25273147 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1
Isonicotinic Acid SCHEMBL25273296 0.95 NAPRT (0.56) CA2NAPRTCA4CA1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 212 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025132951-A1 AQUEOUS COMPOSITION WITH A SENNOSIDE AND AT LEAST ONE HYDROTROPE AGENT L'OREAL (FR) 2025-06-26 — — WO claimed
US-20250049674-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING AT LEAST A MEROCYANINE AND A HYDROTROPE L'OREAL (FR) 2025-02-13 — — US claimed
US-20240423888-A1 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION COMPRISING AT LEAST ONE MEROCYANINE AND AT LEAST ASCORBIC ACID AND/OR A DERIVATIVE THEREOF L'OREAL (FR) 2024-12-26 — — US claimed
CN-118871078-A Cosmetic or dermatological composition comprising at least a merocyanine and a hydrotrope 欧莱雅 2024-10-29 — — CN claimed
EP-4447895-A1 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION COMPRISING AT LEAST ONE MEROCYANINE AND AT LEAST ASCORBIC ACID AND/OR A DERIVATIVE THEREOF L'OREAL (FR) 2024-10-23 — — EP claimed
CN-118804735-A Cosmetic and/or dermatological composition comprising at least one merocyanine and at least ascorbic acid and/or derivatives thereof 莱雅公司 2024-10-18 — — CN claimed
US-20240322260-A1 SECONDARY BATTERY AND ELECTRICAL APPARATUS CONTAINING THE SAME CONTEMPORARY AMPEREX TECHNOLOGY (HONG KONG) LIMITED (CN) 2024-09-26 — — US claimed
CN-117904657-A Carbon material supported alloy electrocatalyst and preparation method and application thereof 西安热工研究院有限公司 2024-04-19 — — CN claimed
EP-4318701-A1 SECONDARY BATTERY AND ELECTRICAL APPARATUS COMPRISING SAME Contemporary Amperex Technology Co., Limited (CN) 2024-02-07 — — EP claimed
CN-115536605-B Preparation method and application of polysubstituted oxazole compound with participation of boron reagent 广东工业大学 2023-12-15 — — CN claimed
US-7008646-B2 Cubic liquid crystalline compositions and methods for their preparation CHILDREN'S HOSPITAL RESEARCH FOUNDATION 2006-03-07 — — US claimed
EP-0897808-B1 Recording sheets and ink jet printing processes therewith XEROX CORP (US) 2004-06-16 — — EP claimed
EP-1361865-A2 CUBIC LIQUID CRYSTALLINE COMPOSITIONS AND METHODS FOR THEIR PREPARATION THE PROCTER & GAMBLE COMPANY (US) 2003-11-19 — — EP claimed
US-20020160040-A1 Cubic liquid crystalline compositions and methods for their preparation CHILDREN'S HOSPITAL RESEARCH FOUNDATION 2002-10-31 — — US claimed
WO-2002066014-A2 CUBIC LIQUID CRYSTALLINE COMPOSITIONS AND METHODS FOR THEIR PREPARATION THE PROCTER & GAMBLE COMPANY (US) 2002-08-29 — — WO claimed
US-6117527-A RECORDING SHEET COMPRISING SUBSTRATE HAVING IMAGE-RECEIVING COATING ON SURFACE COMPRISING BINDER POLYMER AND SELECTED ADDITIVE; HIGH QUALITY IMAGES WITH REDUCED OR NO HAZE XEROX CORPORATION (US) 2000-09-12 — — US claimed
EP-0897808-A1 Recording sheets and ink jet printing processes therewith Xerox Corporation (US) 1999-02-24 — — EP claimed
EP-0272903-B1 PROCESS FOR PRODUCING A POLYARYLENE SULFIDE Tosoh Corporation (JP) 1993-07-21 — — EP claimed
US-4794163-A HIGH MOLECULAR WEIGHT, HEAT RESISTANCE TOSOH CORPORATION (JP) 1988-12-27 — — US claimed
EP-0272903-A2 Process for producing a polyarylene sulfide Tosoh Corporation (JP) 1988-06-29 — — EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240423888-A1 COSMETIC AND/OR DERMATOLOGICAL COMPOSITION COMPRISING AT LEAST ONE MEROCYANINE AND AT LEAST ASCORBIC ACID AND/OR A DERIVATIVE THEREOF KRT18, PROC, DSC1 CA2 797/4885CA4 655/4885CA1 1327/4885
US-20250049674-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING AT LEAST A MEROCYANINE AND A HYDROTROPE NAPRT, NAMPT, NNMT CA2 393/4885CA4 843/4885CA1 440/4885
US-20020160040-A1 Cubic liquid crystalline compositions and methods for their preparation SKP1, CCNB1, CRYAA CA2 364/4885CA4 254/4885CA1 54/4885
US-20240322260-A1 SECONDARY BATTERY AND ELECTRICAL APPARATUS CONTAINING THE SAME SOD1, SOD3, CAT CA2 94/4885CA4 724/4885CA1 21/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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