SCHEMBL535327

SCHEMBL535327

O=C(O)c1ccc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C19 P33261 2/20 0.58
FLT1 P17948 1/20 0.57
FLT4 P35916 1/20 0.57
KDR P35968 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
TSHR P16473 2/20 0.55
CASP1 P29466 1/20 0.55
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 2/20 0.51
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
APP P05067 1/20 0.50
VCAM1 P19320 1/20 0.50
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49

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
Hydrochloric Acid SCHEMBL9650930 0.98 HPGD (0.57) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL27637383 0.88 KMT2A (0.57) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL11301098 0.87 HPGD (0.59) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL6224258 0.86 CYP1A2 (0.49) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL2204732 0.85 HPGD (0.57) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL79163 0.85 DTYMK (0.62) HPGDCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL6896167 0.84 HPGD (0.56) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL848335 0.84 HPGD (0.56) HPGDCYP1A2CYP3A4CYP2C19FLT1
SCHEMBL29758067 0.84 HPGD (0.56) HPGDCYP1A2CYP3A4CYP2C19FLT1
Hydrochloric Acid SCHEMBL1138798 0.84 DTYMK (0.60) HPGDCYP1A2CYP3A4CYP2C19SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116338060-B Determination method of genotoxic impurities in chemical bulk drug containing amino 成都硕德药业有限公司 2025-06-03 CN claimed
CN-114213202-B Preparation method of 2, 4-substituted benzoic acid 石河子大学 2024-07-05 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117024379-B Preparation method and application of 2-amino-4- (4-methyl-1-piperazine) benzoic acid tert-butyl ester 济南国鼎医药科技有限公司 2023-12-12 CN claimed
CN-117024379-A Preparation method and application of 2-amino-4- (4-methyl-1-piperazine) benzoic acid tert-butyl ester 济南国鼎医药科技有限公司 2023-11-10 CN claimed
CN-113880762-B Triacylamine derivatives containing 1,8-naphthalimide as well as preparation method and application thereof 河北农业大学 2023-02-21 CN claimed
CN-114656455-B Triazole modified ferric oxide photocatalyst and preparation method thereof 常熟华虞环境科技有限公司 2022-08-09 CN claimed
CN-114656455-A Triazole modified ferric oxide photocatalyst and preparation method thereof 常熟华虞环境科技有限公司 2022-06-24 CN claimed
CN-111635358-B Preparation method of hydroxychloroquine 北京成宇化工有限公司 2022-06-03 CN claimed
CN-114213202-A Preparation method of 2, 4-substituted benzoic acid 石河子大学 2022-03-22 CN claimed
EP-0923867-B1 Antimicrobial compositions and their use KURITA WATER IND LTD (JP) 2003-11-05 EP claimed
WO-2001056385-A1 METHODS AND COMPOSITIONS FOR ENHANCING FORMYLTETRAHYDROPTEROYLPOLYGLUTAMATE IN PLANTS NONOMURA ARTHUR M (US) 2001-08-09 WO claimed
US-6159999-A Antimicrobial and antiseptic methods using antimicrobial composition KURITA WATER INDUSTRIES LTD. (JP) 2000-12-12 US claimed
EP-0813510-A4 METHODS AND COMPOSITIONS FOR ENHANCING FORMYLTETRAHYDROPTEROYLPOLYGLUTAMATE IN PLANTS NONOMURA ARTHUR M (US) 2000-07-26 EP claimed
EP-0923867-A1 Antimicrobial composition and their use KURITA WATER INDUSTRIES LTD. (JP) 1999-06-23 EP claimed
EP-0813510-A1 METHODS AND COMPOSITIONS FOR ENHANCING FORMYLTETRAHYDROPTEROYLPOLYGLUTAMATE IN PLANTS NONOMURA, Arthur M. (US) 1997-12-29 EP claimed
EP-0519971-B1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE INST SOZIAL MED FORSCHUNG SA (CH) 1997-01-15 EP claimed
WO-1996027572-A1 METHODS AND COMPOSITIONS FOR ENHANCING FORMYLTETRAHYDROPTEROYLPOLYGLUTAMATE IN PLANTS NONOMURA ARTHUR M (US) 1996-09-12 WO claimed
EP-0519971-A1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE. EEC PHARMA SA (FR) 1992-12-30 EP claimed
WO-1991013886-A1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE EEC-PHARMA S.A. (FR) 1991-09-19 WO claimed