SCHEMBL17310312

SCHEMBL17310312

O=C(Nc1n[nH]c2ccccc12)ON1CCc2c([nH]c3cc(Cl)ccc23)C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.49
FAAH O00519 1/20 0.41
GSK3B P49841 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MCL1 Q07820 1/20 0.41
GPX4 P36969 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40
MAPK10 P53779 3/20 0.40
MAPK8 P45983 2/20 0.40

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
SCHEMBL17310341 0.93 TRPV1 (0.49) TRPV1FAAHMEN1KMT2ACYP1A2
SCHEMBL17310327 0.91 TRPV1 (0.49) TRPV1FAAHGPX4
SCHEMBL17310343 0.89 TRPV1 (0.47) TRPV1FAAHMAPK10MAPK8
SCHEMBL17310353 0.87 TRPV1 (0.42) TRPV1FAAHGPX4MAPK10MAPK8
SCHEMBL17310289 0.87 TRPV1 (0.49) TRPV1GSK3BMAPK10MAPK8
SCHEMBL17310270 0.85 TRPV1 (0.43) TRPV1FAAHMAPK10MAPK8
SCHEMBL17310344 0.85 TRPV1 (0.40) TRPV1FAAHMEN1KMT2AGPX4
SCHEMBL17310310 0.85 TRPV1 (0.49) TRPV1FAAH
SCHEMBL2273052 0.84 TRPV1 (0.66) TRPV1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL17310340 0.84 PARP1 (0.42) TRPV1FAAHMAPK10MAPK8

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
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP claimed