SCHEMBL519094

SCHEMBL519094

COC(=O)c1ncccc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.67
ALDH1A1 P00352 5/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
CYP3A4 P08684 1/20 0.67
MAPT P10636 1/20 0.67
ALOX15 P16050 1/20 0.67
TSHR P16473 1/20 0.67
BLM P54132 1/20 0.67
AGER Q15109 1/20 0.67
TDP1 Q9NUW8 2/20 0.54
NAPRT Q6XQN6 2/20 0.50
HTT P42858 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PKM P14618 2/20 0.49
MAP2K1 Q02750 1/20 0.47
DHODH Q02127 1/20 0.47

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
SCHEMBL29559479 1.00 KDM4E (0.67) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL29416324 0.89 L3MBTL1 (0.62) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL69990 0.89 L3MBTL1 (0.62) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL519095 0.86 KDM4E (0.67) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL30503698 0.86 KDM4E (0.67) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL9632137 0.86 L3MBTL1 (0.58) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL311087 0.85 KDM4E (0.71) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL7367762 0.84 L3MBTL1 (0.50) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL7362858 0.84 KDM4E (0.56) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4
SCHEMBL2372518 0.84 L3MBTL1 (0.57) KDM4EALDH1A1L3MBTL1NPSR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109705116-A A kind of synthetic method of 6- benzyl-pyrrole simultaneously [3,4-b] pyridine 赵明 2019-05-03 CN claimed
CN-109503823-A A kind of low temperature curing type polyester resin and the preparation method and application thereof 黄山学院 2019-03-22 CN claimed
CN-104363887-B Compositions, methods and uses comprising pyridine dicarboxylic acid esters and esters of glucose and fatty acids 莱雅公司 2017-11-10 CN claimed
CN-107106452-A Specific pyridinedicarboxylicacid acid derivatives/antioxidant combination 欧莱雅 2017-08-29 CN claimed
CN-106587318-A High-efficiency heavy metal waste water treating agent 余姚市益群机械厂 2017-04-26 CN claimed
EP-1327630-B1 NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION ESTEVE LABOR DR (ES) 2007-12-12 EP claimed
US-7300937-B2 Derivatives of cyano-aryl (or cyanoheteroaryl)-carbonyl-piperazinyl-pyrimidines, their preparation and application as medication LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-11-27 US claimed
US-20040048872-A1 New derivatives of cyano-aryl (or cyanoheteroaryl) -carbonyl- piperazinyl - pyrimidines, their preparation and application as medication LABORATORIES DEL DR. ESTEVE, S.A. (ES) 2004-03-11 US claimed
EP-1327630-A1 NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2003-07-16 EP claimed
EP-4126832-B1 MODULATORS OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS INC (US) 2026-01-07 EP disclosed
US-12378254-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2025-08-05 US disclosed
EP-4541422-A2 QUINOLINE DERIVATIVES AS ALPHA4BETA7 INTEGRIN INHIBITORS Gilead Sciences, Inc. (US) 2025-04-23 EP disclosed
US-20250032473-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2025-01-30 US disclosed
CN-113563244-B Substituted aza five-membered ring compound and application thereof in medicine 广东东阳光药业股份有限公司 2025-01-10 CN disclosed
US-4525555-A TITANIUM COMPOUND SUPPORTED ON SOLID REACTION PRODUCT OF MAGNESIUM HALIDE, SILOXANES, ORGANIC COMPOUNDS NIPPON OIL COMPANY, LIMITED (JP) 1985-06-25 US disclosed
US-4405791-A Arylthioureido pyridinecarbamino compounds and use as plant growth regulants GULF OIL CORPORATION (US) 1983-09-20 US disclosed
US-4292069-A HERBICIDES GULF OIL CORPORATION (US) 1981-09-29 US disclosed
EP-0030789-A2 Arylthioureido pyridinecarbamino compounds, a process for their preparation and their use as plant growth regulants Gulf Oil Corporation (US) 1981-06-24 EP disclosed
US-3996208-A PENICILLINS CIBA-GEIGY CORPORATION (US) 1976-12-07 US disclosed
US-3964974-A Enzymatic determination of glucose MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-06-22 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 (3 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-20040048872-A1 New derivatives of cyano-aryl (or cyanoheteroaryl) -carbonyl- piperazinyl - pyrimidines, their preparation and application as medication CBR3, CBR1, CNR1 KDM4E 1472/4885ALDH1A1 304/4885L3MBTL1 1773/4885
US-12378254-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators HCRTR2, HCRTR1, OXTR KDM4E 454/4885ALDH1A1 3132/4885L3MBTL1 4510/4885
US-20250032473-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 KDM4E 2522/4885ALDH1A1 476/4885L3MBTL1 4861/4885

“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.