SCHEMBL6465460

SCHEMBL6465460

NC(=O)NSc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
CES1 P23141 1/20 0.46
MAPK1 P28482 2/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PLAU P00749 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.44
IDO1 P14902 2/20 0.44
NOS1 P29475 2/20 0.43
NOS3 P29474 1/20 0.42

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
SCHEMBL27499999 0.98 TSHR (0.50) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL27798703 0.91 KMT2A (0.54) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL27930669 0.82 CYP3A4 (0.52) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL19345858 0.82 MAPK1 (0.52) MEN1KMT2AMAPTLMNAGAA
SCHEMBL27668171 0.80 HSP90AA1 (0.57) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL19346211 0.79 MEN1 (0.47) MEN1KMT2AMAPTLMNAGAA
SCHEMBL1532181 0.77 TSHR (0.59) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL6562489 0.76 IDO1 (0.61) TSHRMEN1KMT2AMAPTLMNA
Urea SCHEMBL27805729 0.76 TSHR (0.74) TSHRMEN1KMT2ALMNAGAA
SCHEMBL19345855 0.76 KMT2A (0.44) MEN1KMT2AMAPTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107056666-B A kind of organogel compound of 4- nitrobenzenes thiocarbamide and preparation method thereof, gel and application 信阳师范学院 2018-09-14 CN claimed
CN-107056666-A A kind of organogel compound of 4 nitrobenzene thiocarbamide and preparation method thereof, gel and application 信阳师范学院 2017-08-18 CN claimed
CN-102079732-B Method for synthesizing 2-amino-4-methylthiazole-5-carboxylate and derivatives thereof UNIV XI AN JIAOTONG 2013-03-13 CN claimed
CN-102079732-A Method for synthesizing 2-amino-4-methylthiazole-5-carboxylate and derivatives thereof UNIV XI AN JIAOTONG 2011-06-01 CN claimed
CN-101687816-A Triaminopyrimidine derivatives as the CDC25 inhibitors of phosphatases IPSEN PHARMA SAS 2010-03-31 CN claimed
CN-100360932-C Reagent for detecting mercury ion in water and its preparation method UNIV XIAMEN (CN) 2008-01-09 CN claimed
CN-1752750-A Reagent for detecting mercury ion in water and its preparation method UNIV XIAMEN (CN) 2006-03-29 CN claimed
EP-1148048-B1 Polyaromatic compounds for treating herpes viral infections PHARMACIA & UPJOHN CO LLC (US) 2005-06-29 EP claimed
CN-107963617-B A kind of production method and system of nitrosyl sulfuric acid ZHEJIANG DIBANG CHEMICAL CO., LTD. (CN) 2019-11-01 CN disclosed
CN-109971202-A A kind of benzothiazoles dispersion dyes monomer compound and its synthetic method and application 浙江迪邦化工有限公司 2019-07-05 CN disclosed
CN-107056666-B A kind of organogel compound of 4- nitrobenzenes thiocarbamide and preparation method thereof, gel and application 信阳师范学院 2018-09-14 CN disclosed
CN-107056666-B A kind of organogel compound of 4- nitrobenzenes thiocarbamide and preparation method thereof, gel and application 信阳师范学院 2018-09-14 CN disclosed
CN-107963617-A The production method and system of a kind of nitrosyl sulfuric acid 浙江迪邦化工有限公司 2018-04-27 CN disclosed
CN-107056666-A A kind of organogel compound of 4 nitrobenzene thiocarbamide and preparation method thereof, gel and application 信阳师范学院 2017-08-18 CN disclosed
CN-101056875-A Substituted phenylaminothiazoles and use thereof BAYER HEALTHCARE AG (DE) 2007-10-17 CN disclosed
CN-1926121-A Thiazole derivatives and uses thereof APPLIED RESEARCH SYSTEMS (AN) 2007-03-07 CN disclosed
CN-1852907-A 2-amino-5-benzoylthiazole npy antagonists HOFFMANN LA ROCHE (CH) 2006-10-25 CN disclosed
CN-1752750-A Reagent for detecting mercury ion in water and its preparation method UNIV XIAMEN (CN) 2006-03-29 CN disclosed
CN-1035253-C Pyranyl cyanoguanidine derivatives SQUIBB & SONS INC (US) 1997-06-25 CN disclosed
CN-1064272-A PYRANYL CYANOGUANIDINE DERIVATIVES SQUIBB & SONS INC (US) 1992-09-09 CN disclosed