Isonicotinic Acid

Isonicotinic Acid

SCHEMBL11323095

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

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

folP

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 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.52
▸ CA2 P00918 10/20 0.50
▸ CA4 P22748 1/20 0.50
▸ 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
▸ ADORA3 P0DMS8 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ CA1 P00915 9/20 0.48
▸ HSD17B10 Q99714 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45

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 SCHEMBL3705303 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25273196 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL5858849 0.95 CA2 (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25261209 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25273147 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25269382 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25273296 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25270921 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL25271513 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1
Isonicotinic Acid SCHEMBL5216523 0.95 NAPRT (0.56) NAPRTALDH1A1CA2CA4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4174447-A SILVER SALTS OF CARBOXY ACIDS STANDARD OIL COMPANY (INDIANA) (US) 1979-11-13 — — US claimed
CN-107261148-B Methylphenidate prodrugs, methods of making and using the same 凯姆制药公司 2021-07-13 — — CN disclosed
EP-3189840-B1 METHYLPHENIDATE-PRODRUGS, PROCESSES OF MAKING AND USING THE SAME KEMPHARM INC (US) 2021-05-19 — — EP disclosed
US-20190142815-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same ALTER DOMUS (US) LLC 2019-05-16 — — US disclosed
US-10231960-B2 Methylphenidate-prodrugs, processes of making and using the same KEMPHARM INC. (US) 2019-03-19 — — US disclosed
EP-3189840-A1 METHYLPHENIDATE-PRODRUGS, PROCESSES OF MAKING AND USING THE SAME Kempharm, Inc. (US) 2017-07-12 — — EP disclosed
EP-2736510-B1 METHYLPHENIDATE-PRODRUGS, PROCESSES OF MAKING AND USING THE SAME KEMPHARM INC (US) 2017-03-01 — — EP disclosed
US-20170049765-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same COMMAVE THERAPEUTICS SA (CH) 2017-02-23 — — US disclosed
US-9453037-B2 Methylphenidate-prodrugs, processes of making and using the same KEMPHARM, INC (US) 2016-09-27 — — US disclosed
US-20150266911-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same COMMAVE THERAPEUTICS SA (CH) 2015-09-24 — — US disclosed
US-20140243291-A1 METHYLPHENIDATE-OXOACID CONJUGATES, PROCESSES OF MAKING AND USING THE SAME COMMAVE THERAPEUTICS SA (CH) 2014-08-28 — — US disclosed
EP-2736510-A2 METHYLPHENIDATE-PRODRUGS, PROCESSES OF MAKING AND USING THE SAME Kempharm, Inc. (US) 2014-06-04 — — EP disclosed
WO-2013016668-A2 METHYLPHENIDATE-PRODRUGS, PROCESSES OF MAKING AND USING THE SAME KEMPHARM INC. (US) 2013-01-31 — — WO disclosed
US-4258129-A IMPROVE GREEN SHELF LIFE FUJI PHOTO FILM CO., LTD. (JP) 1981-03-24 — — US disclosed
US-4211839-A SILVER HALIDE AND ORGANIC SILVER SALT PREPARED IN AN IMINO COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1980-07-08 — — US disclosed
US-4188212-A BEZNOTRIAZOLE FUJI PHOTO FILM CO., LTD. (JP) 1980-02-12 — — US disclosed
US-4188274-A DECARBOXYLATION STANDARD OIL COMPANY (INDIANA) (US) 1980-02-12 — — US disclosed
US-4174447-A SILVER SALTS OF CARBOXY ACIDS STANDARD OIL COMPANY (INDIANA) (US) 1979-11-13 — — US disclosed
US-4012454-A Iodination process STANDARD OIL COMPANY (INDIANA) (US) 1977-03-15 — — US disclosed
US-3970658-A Nitrile process STANDARD OIL COMPANY (US) 1976-07-20 — — US disclosed

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

For each of this compound's patents that has machine-readable text (5 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-20140243291-A1 METHYLPHENIDATE-OXOACID CONJUGATES, PROCESSES OF MAKING AND USING THE SAME COMT, PNMT, SLC6A3 NAPRT 836/4885ALDH1A1 97/4885CA2 3529/4885
US-20170049765-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same COMT, TPMT, PNMT NAPRT 517/4885ALDH1A1 103/4885CA2 3802/4885
US-20150266911-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same COMT, TPMT, PNMT NAPRT 517/4885ALDH1A1 103/4885CA2 3802/4885
US-20190142815-A1 Methylphenidate-Prodrugs, Processes of Making and Using the Same COMT, TPMT, PNMT NAPRT 517/4885ALDH1A1 103/4885CA2 3802/4885
US-10231960-B2 Methylphenidate-prodrugs, processes of making and using the same COMT, TPMT, PNMT NAPRT 517/4885ALDH1A1 103/4885CA2 3802/4885

“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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