SCHEMBL27274151

SCHEMBL27274151

NC(=O)c1ccccc1-c1c[nH]nn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.53
CSNK1A1 P48729 1/20 0.46
TYRO3 Q06418 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
NUDT1 P36639 1/20 0.41
CHEK1 O14757 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRM5 P41594 1/20 0.40
METAP2 P50579 1/20 0.38
CTNNB1 P35222 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL29395860 1.00 BCAT2 (0.53) BCAT2CSNK1A1TYRO3DYRK1BNUDT1
SCHEMBL11509759 0.86 BCAT2 (0.35) BCAT2CSNK1A1TYRO3DYRK1BNPC1
SCHEMBL11471190 0.85 RAB9A (0.45) BCAT2NPC1RAB9AKDM4EALDH1A1
SCHEMBL31092004 0.85 RAB9A (0.45) BCAT2NPC1RAB9AKDM4EALDH1A1
SCHEMBL10664169 0.83 KDM4C (0.47) CSNK1A1TYRO3DYRK1BCHEK1NPC1
SCHEMBL11357674 0.83 ALDH1A1 (0.39) BCAT2CSNK1A1TYRO3DYRK1BNPC1
SCHEMBL21802450 0.83 CTSD (0.44) ALDH1A1MAPT
SCHEMBL29903396 0.81 PARP1 (0.40) BCAT2CSNK1A1TYRO3DYRK1BCHEK1
SCHEMBL10811664 0.81 ALDH1A1 (0.45) ALDH1A1MAPTATM
SCHEMBL17188156 0.80 CASP1 (0.38) BCAT2CSNK1A1TYRO3DYRK1BCHEK1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1058694-A Contain 1,2, the Herbicidal combinations of 4-triazole-3-formamide and control method for weed with said composition KUREHA CHEMICAL IND CO LTD (JP) 1992-02-19 CN claimed
CN-1015455-B Process for producing 1, 2, 4-triazole-3-carboxamide compound KUREHA CHEMICAL IND CO LTD (JP) 1992-02-12 CN claimed
CN-86108483-A 1. 2, 4-triazole-3-carboxamide compound, preparation method thereof and herbicidal composition containing same 1987-09-16 CN claimed
EP-4003965-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION Nurix Therapeutics, Inc. (US) 2022-06-01 EP disclosed
CN-105555788-B Triazol [4,5-d] pyrimidine derivatives 豪夫迈·罗氏有限公司 2018-11-23 CN disclosed
CN-107428740-A Indazolyl-and indolyl-benzamide derivatives 埃萨内克斯股份有限公司 2017-12-01 CN disclosed
CN-102595904-B Novel compositions and methods for preparing 5-amino or substituted amino 1,2, 3-triazoles and triazole orotate formulations 巧妙疗法股份有限公司 2016-08-03 CN disclosed
CN-104817507-A Novel compositions and processes for preparing 5-amino or substituted amino 1,2,3-triazoles and triazole orotate formulations TACTICAL THERAPEUTICS INC 2015-08-05 CN disclosed
CN-102595904-A Novel compositions and methods for preparing 5-amino or substituted amino 1,2, 3-triazoles and triazole orotate formulations TACTICAL THERAPEUTICS INC 2012-07-18 CN disclosed
CN-101273988-B Treatment and prevention of neoplasms with salts of aminoimidazole carboxamide and 5-amino or substituted amino 1,2,3-triazoles TACTICAL THERAPEUTICS, INC. (US) 2011-12-14 CN disclosed
CN-101273988-A Treatment and prevention of neoplasms with salts of aminoimidazole carboxamide and 5-amino or substituted amino 1,2,3-triazoles TACTICAL THERAPEUTICS INC (US) 2008-10-01 CN disclosed
CN-1318029-C Use of salts of aminoimidazole carboxamides and of 5-amino or substituted amino 1,2, 3-triazoles for preparing pharmaceutical compositions for the treatment and prevention of tumors CONSTANTIA GROUPE CORP (US) 2007-05-30 CN disclosed
CN-1191485-A Treatment and prevention of tumors with salts of aminoimidazole carboxamides and 5-amino or substituted amino 1,2, 3-triazoles CONSTANTIA GROUPE CORP (AT) 1998-08-26 CN disclosed
CN-1058694-A Contain 1,2, the Herbicidal combinations of 4-triazole-3-formamide and control method for weed with said composition KUREHA CHEMICAL IND CO LTD (JP) 1992-02-19 CN disclosed
CN-86108483-A 1. 2, 4-triazole-3-carboxamide compound, preparation method thereof and herbicidal composition containing same 1987-09-16 CN disclosed