SCHEMBL9717707

SCHEMBL9717707

CCCCc1ccc(O)c(/N=N/c2ccccc2[N+](=O)[O-])c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PTPN11 Q06124 4/20 0.42
PLAU P00749 1/20 0.40
CES2 O00748 1/20 0.39
ACHE P22303 1/20 0.39
CES1 P23141 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL9717709 1.00 NPC1 (0.43) NPC1RAB9APTPN11PLAUCES2
SCHEMBL5835286 0.95 KAT8 (0.45) NPC1RAB9APTPN11
SCHEMBL11665171 0.95 KAT8 (0.45) NPC1RAB9APTPN11
SCHEMBL28309260 0.95 KAT8 (0.45) NPC1RAB9APTPN11
SCHEMBL5835290 0.95 KAT8 (0.45) NPC1RAB9APTPN11
SCHEMBL28309259 0.95 KAT8 (0.45) NPC1RAB9APTPN11
SCHEMBL7568855 0.89 PTPN11 (0.43) NPC1RAB9APTPN11PLAUCYP1A2
SCHEMBL7568853 0.89 PTPN11 (0.43) NPC1RAB9APTPN11PLAUCYP1A2
SCHEMBL7566182 0.88 PTPN11 (0.42) NPC1RAB9APTPN11PLAUCYP1A2
SCHEMBL7566189 0.88 PTPN11 (0.42) NPC1RAB9APTPN11PLAUCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259530-B1 METHOD FOR PREPARING 2-PHENYLBENZOTRIAZOLES AND 2-PHENYLBENZOTRIAZOLE-N-OXIDES CHEMIPRO KASEI KAISHA LTD (JP) 1992-04-08 EP disclosed
US-4780541-A Method for preparing 2-phenylbenzotriazoles and 2-phenylbenzotriazole-N-oxides CHEMIPRO KASEI KAISHA, LTD. (JP) 1988-10-25 US disclosed