SCHEMBL7752902

SCHEMBL7752902

Cc1occc1OC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 3/20 0.40
PKM P14618 1/20 0.40
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
ESR2 Q92731 1/20 0.36
POLB P06746 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HTT P42858 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL3420715 0.82 KDM4E (0.41) ALOX5SMN1; SMN2NPC1RAB9APKM
SCHEMBL27487498 0.82 CFD (0.43) SMN1; SMN2RAB9ALMNAKDM4EALDH1A1
SCHEMBL10499180 0.78 KDM4E (0.44) SMN1; SMN2NPC1LMNAKDM4EALDH1A1
SCHEMBL31447708 0.71 KDM4E (0.39) ALOX5SMN1; SMN2NPC1LMNAKDM4E
SCHEMBL8038327 0.69 MAPT (0.44) ALOX5SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8014964 0.69
SCHEMBL8585126 0.68 MAPK1 (0.52) ALOX5SMN1; SMN2NPC1RAB9APKM
SCHEMBL302524 0.68
SCHEMBL27595332 0.67
SCHEMBL473212 0.67 ATM (0.47) SMN1; SMN2NPC1RAB9ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001030154-A2 AGROCHEMICAL COMPOSITIONS CONTAINING PYRAZOLES AND USE THEREOF AS FUNGICIDAL PLANT PROTECTION AGENTS BASF AKTIENGESELLSCHAFT (DE) 2001-05-03 WO disclosed