SCHEMBL9007271

SCHEMBL9007271

CC(C)(C)c1cc(N=Nc2ccccc2[N+](=O)[O-])c(O)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PTPN11 Q06124 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
GALR3 O60755 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PLAU P00749 1/20 0.41
CES2 O00748 2/20 0.41
ACHE P22303 2/20 0.41
CES1 P23141 2/20 0.41
CYP1A2 P05177 2/20 0.40
GPR35 Q9HC97 2/20 0.40
HPGD P15428 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
CCNT1 O60563 1/20 0.39
CCNB2 O95067 1/20 0.39

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
SCHEMBL9007267 1.00 NPC1 (0.44) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL7523501 0.90 NPC1 (0.41) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL7523500 0.90 NPC1 (0.41) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL7699959 0.88 NPC1 (0.45) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL11733347 0.88 NPC1 (0.45) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL7699961 0.88 NPC1 (0.45) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL11733352 0.88 NPC1 (0.45) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL9178108 0.87 NPC1 (0.44) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL29488570 0.87 NPC1 (0.44) NPC1RAB9APTPN11SMN1; SMN2HTT
SCHEMBL9178099 0.87 NPC1 (0.44) NPC1RAB9APTPN11SMN1; SMN2HTT

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
US-5571924-A Process for the preparation of benzotriazoles CIBA-GEIGY CORPORATION (US) 1996-11-05 US disclosed
US-5436322-A Azo coupling of 2-nitroanilines with 2,4,-disbustituted phenols CIBA-GEIGY CORPORATION (US) 1995-07-25 US disclosed
EP-0380840-B1 Method of preparing 2-phenylbenzotriazoles CHEMIPRO KASEI KAISHA LTD (JP) 1995-05-17 EP disclosed
US-5276161-A Catalytic hydrogenation of o-nitrophenylazohydroxyphenyl compounds; noble metal catalyst and organic amine CIBA-GEIGY CORPORATION (US) 1994-01-04 US disclosed
EP-0419412-B1 Process for the preparation of benzotriazoles CIBA GEIGY AG (CH) 1993-11-10 EP disclosed
US-5187289-A Method of preparing 2-phenyl benzotriazoles CHEMIPRO KASEI KAISHA, LTD. (JP) 1993-02-16 US disclosed
EP-0263905-B1 METHOD FOR PREPARING 2-PHENYLBENZOTRIAZOLES AND 2-PHENYLBENZOTRIAZOLE-N-OXIDES CHEMIPRO KASEI KAISHA, LTD. (JP) 1992-04-15 EP disclosed
US-5104992-A METHOD OF PREPARING 2-PHENYL BENEZOTHRIAZOLES CHEMIPRO KASEI KAISHA, LTD. (JP) 1992-04-14 US disclosed
EP-0419412-A2 Process for the preparation of benzotriazoles CIBA-GEIGY AG (CH) 1991-03-27 EP disclosed
EP-0380839-A1 Method of preparing 2-phenylbenzotriazoles CHEMIPRO KASEI KAISHA, LTD. (JP) 1990-08-08 EP disclosed
EP-0160246-B1 A METHOD FOR PRODUCING A 2-PHENYLBENZOTRIAZOLE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-01-24 EP disclosed
US-4835284-A Method for preparing 2-phenylbenzotriazoles and 2-phenylbenzotriazole-N-oxides CHEMIPRO KASEI KAISHA, LTD. (JP) 1989-05-30 US disclosed
EP-0130938-B1 PROCESS FOR THE PREPARATION OF 2-ARYLBENZOTRIAZOLES CIBA-GEIGY AG (CH) 1989-02-15 EP disclosed
EP-0263905-A1 Method for preparing 2-phenylbenzotriazoles and 2-phenylbenzotriazole-N-oxides CHEMIPRO KASEI KAISHA, LTD. (JP) 1988-04-20 EP disclosed
US-4642350-A Novel process for preparation of benzotriazoles using aryldiols and quinones CIBA-GEIGY CORPORATION (US) 1987-02-10 US disclosed
EP-0160246-A1 A method for producing A 2-phenylbenzotriazole SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-11-06 EP disclosed
EP-0130938-A2 Process for the preparation of 2-arylbenzotriazoles CIBA-GEIGY AG (CH) 1985-01-09 EP disclosed
US-4230867-A REDUCTION, CYCLIZATION OF NITROAZOBENZENES CIBA-GEIGY CORPORATION (US) 1980-10-28 US disclosed
US-4220788-A Process for the preparation of 2-aryl-2H-benzotriazoles CIBA-GEIGY CORPORATION (US) 1980-09-02 US disclosed
US-4219480-A REDUCTION OF UNDESIRED BY-PRODUCT AND EFFLUENT POLLUTION PROBLEMS CIBA-GEIGY CORPORATION (US) 1980-08-26 US disclosed