SCHEMBL3978031

SCHEMBL3978031

Cc1cccc2c(C(=O)O)c[nH]c12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.77
NR4A2 P43354 2/20 0.71
CNR2 P34972 1/20 0.56
TRIM24 O15164 1/20 0.54
TRIM33 Q9UPN9 1/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
HTT P42858 3/20 0.54
TSHR P16473 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 1/20 0.53
RAB9A P51151 1/20 0.53
KDM4E B2RXH2 3/20 0.53
AR P10275 1/20 0.49
NPC1 O15118 1/20 0.49
CSNK2A2 P19784 1/20 0.49
CSNK2B P67870 1/20 0.49
CSNK2A1 P68400 1/20 0.49
HSD17B10 Q99714 1/20 0.48
DNA2 P51530 1/20 0.48

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
SCHEMBL2977498 0.90 KDM4E (0.67) BRPF1NR4A2CNR2TRIM24TRIM33
Hydrochloric Acid SCHEMBL28606562 0.89 KDM4E (0.65) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL27599870 0.88 BRPF1 (0.71) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL25139503 0.83 BRPF1 (0.69) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL13715378 0.83 BRPF1 (0.69) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL3720911 0.83 BRPF1 (0.69) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL2036909 0.83 NR4A2 (1.00) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL13715439 0.83 BRPF1 (0.69) BRPF1NR4A2CNR2TRIM24TRIM33
SCHEMBL29415445 0.82 HTT (0.59) BRPF1NR4A2ALDH1A1HPGDHTT
SCHEMBL2811213 0.82 HTT (0.59) BRPF1NR4A2ALDH1A1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306651-A Indole 3-amide derivative and preparation method and application thereof 山东大学 2025-01-14 CN disclosed
CN-119307565-A Method for synthesizing L-7-methyl tryptophan by enzyme method 浙江普洛生物科技有限公司 2025-01-14 CN disclosed
CN-117756785-A Preparation and application of N- (pyridine-2-yl) benzo [ b ] five-membered heterocycle-3-carboxamide structure compound 江西中医药大学 2024-03-26 CN disclosed
CN-117603123-A Novel indole HDAC6 small molecule inhibitor, preparation method and application 郑州大学 2024-02-27 CN disclosed
CN-117603120-A Preparation method and application of indole-3-fluoroketone compound 平顶山学院 2024-02-27 CN disclosed
US-20230121337-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. 2023-04-20 US disclosed
US-20170166561-A1 QUINUCLIDINE COMPOUNDS FOR MODULATING ALPHA7-NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY ALPHARMAGEN LLC (US) 2017-06-15 US disclosed
US-9434724-B2 Quinuclidines for modulating alpha 7 activity ALPHARMAGEN, LLC (US) 2016-09-06 US disclosed
US-20160009706-A1 QUINUCLIDINES FOR MODULATING ALPHA 7 ACTIVITY ALPHARMAGEN, LLC 2016-01-14 US disclosed
WO-2016007630-A1 QUINUCLIDINE COMPOUNDS FOR MODULATING ALPHA7 -NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY ALPHARMAGEN, LLC (US) 2016-01-14 WO disclosed
US-20090258876-A1 NOVEL INDOL CARBOXYLIC ACID BISPYRIDYL CARBOXAMIDE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD AND COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-10-15 US disclosed
WO-2009125923-A2 NOVEL INDOL CARBOXYLIC ACID BISPYRIDYL CARBOXAMIDE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD AND COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT KOREA RESERACH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-10-15 WO disclosed
EP-2108649-A1 Novel indol carboxylic acid bispyridyl carboxamide derivatives as 5-HT2c receptor antagonists Korea Research Institute of Chemical Technology (KR) 2009-10-14 EP disclosed
WO-2009060030-A1 HETEROARYL-SUBSTITUTED 2-PYRIDINYLMETHYLAMINE DERIVATIVES Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2009-05-14 WO disclosed
EP-2058306-A1 Heteroaryl-substituted 2-pyridinyl-methylamine derivatives SCHWARZ PHARMA AG (DE) 2009-05-13 EP disclosed
WO-1998028292-A1 NOVEL PIPERIDINE CONTAINING COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1998-07-02 WO disclosed
EP-0328200-B1 Five-membered ring systems with bonded azacyclic ring substituents MERCK SHARP & DOHME (GB) 1993-12-08 EP disclosed
US-5041456-A Pharmaceutically useful 3-(indol-3-yl)-1,2,4-oxa- and thiadiazoles substituted in the 5-position by an amino containing group MERCK SHARP & DOHME LTD. (GB) 1991-08-20 US disclosed
US-4952587-A PSYCHOLOGICAL DISORDERS, MIGRAINES, ALZHEIMER*S MERCK SHARP & DOHME LTD. (GB) 1990-08-28 US disclosed
EP-0328200-A1 Five-membered ring systems with bonded azacyclic ring substituents MERCK SHARP & DOHME LTD. (GB) 1989-08-16 EP 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 (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-20230121337-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 BRPF1 1721/4885NR4A2 3309/4885CNR2 3600/4885
US-20090258876-A1 NOVEL INDOL CARBOXYLIC ACID BISPYRIDYL CARBOXAMIDE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD AND COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT HTR2C, HTR5A, HTR2A BRPF1 3481/4885NR4A2 1506/4885CNR2 14/4885
US-20160009706-A1 QUINUCLIDINES FOR MODULATING ALPHA 7 ACTIVITY CHRNA7, CHRNA2, CHRNA5 BRPF1 3390/4885NR4A2 638/4885CNR2 139/4885
US-20170166561-A1 QUINUCLIDINE COMPOUNDS FOR MODULATING ALPHA7-NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY CHRNA7, CHRNA2, CHRNA6 BRPF1 2834/4885NR4A2 358/4885CNR2 108/4885

“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.