SCHEMBL405123

SCHEMBL405123

NCc1ccccc1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPT P10636 2/20 0.52
TSHR P16473 2/20 0.52
HSD17B10 Q99714 2/20 0.52
HPGD P15428 1/20 0.52
METAP2 P50579 1/20 0.48
BCAT2 O15382 1/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PNMT P11086 1/20 0.43
GAA P10253 1/20 0.42
CTNNB1 P35222 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
NPC1 O15118 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
RAB9A P51151 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3076314 0.84 PNMT (0.44) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL7134588 0.84 TSHR (0.54) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL4735612 0.84 ALDH1A1 (0.54) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL2242560 0.84 BCAT2 (0.55) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL731621 0.83 HMGB1 (0.55) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL162322 0.82 MAPT (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL5252886 0.82 KDM4E (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL619877 0.82 ALDH1A1 (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL6555382 0.82 MAPT (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL136079 0.82 FOLH1 (0.59) KDM4EALDH1A1MAPTTSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101795688-B Application of 4- (pyrrolidine-1-yl) quinoline compound in preparation of medicine for killing clinically latent microorganisms HELPERBY THERAPEUTICS LTD 2015-05-20 CN claimed
JP-4791460-B2 2011-10-12 JP claimed
CN-100354252-C Production process of aminomethyl group-containing benzamide compound SHOWA DENKO KK (JP) 2007-12-12 CN claimed
EP-1773786-A2 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS Bristol-Myers Squibb Company (US) 2007-04-18 EP claimed
WO-2005123050-A2 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-29 WO claimed
CN-1656056-A Production process of aminomethyl group-containing benzamide compound SHOWA DENKO KK (JP) 2005-08-17 CN claimed
EP-1506160-A1 PRODUCTION PROCESS OF AMINOMETHYL GROUP-CONTAINING BENZAMIDE COMPOUND Showa Denko K.K. (JP) 2005-02-16 EP claimed
WO-2003097579-A1 PRODUCTION PROCESS OF AMINOMETHYL GROUP-CONTAINING BENZAMIDE COMPOUND SHOWA DENKO K. K. (JP) 2003-11-27 WO claimed
US-4016257-A Amide derivatives of acids, an antibiotic produced by Polyangium cellulosum var. fulvum WARNER-LAMBERT COMPANY (US) 1977-04-05 US claimed
CN-116444381-B Xylylenediamine and a ring preparation method of hexamethylenediamine 江西仰立新材料有限公司 2024-09-06 CN disclosed
CN-117940388-A Method for producing mineral fibre products 洛科威有限公司 2024-04-26 CN disclosed
CN-117839717-A Catalyst and method for coproducing XDA and BAC through XPN hydrogenation 万华化学集团股份有限公司 2024-04-09 CN disclosed
CN-117279872-A Method for producing mineral wool products 洛科威有限公司 2023-12-22 CN disclosed
CN-117164251-A Mineral wool binder 洛科威有限公司 2023-12-05 CN disclosed
EP-0817630-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-14 EP disclosed
WO-1996037204-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-11-28 WO disclosed
US-5578629-A ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-11-26 US disclosed
WO-1996030015-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed
US-5534537-A Prodrugs of inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1996-07-09 US disclosed
US-4016257-A Amide derivatives of acids, an antibiotic produced by Polyangium cellulosum var. fulvum WARNER-LAMBERT COMPANY (US) 1977-04-05 US disclosed