SCHEMBL9490339

SCHEMBL9490339

O=C(O)NC1CCc2ccccc2C1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.57
EPHX2 P34913 4/20 0.46
ATM Q13315 1/20 0.46
NPY5R Q15761 1/20 0.45
SLC22A1 O15245 1/20 0.44
PRCP P42785 1/20 0.44
SLC6A9 P48067 1/20 0.43
HTR1A P08908 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
SCHEMBL23772363 0.89 TRPV1 (0.55) TRPV1EPHX2ATMNPY5RSLC6A9
SCHEMBL9854680 0.89 TRPV1 (0.55) TRPV1EPHX2ATMNPY5RSLC6A9
SCHEMBL9854669 0.87 TRPV1 (0.53) TRPV1EPHX2ATMNPY5RSLC6A9
SCHEMBL14957415 0.86 TRPV1 (0.52) TRPV1SLC6A9
SCHEMBL3094360 0.84 SLC6A9 (0.50) TRPV1NPY5RSLC6A9
SCHEMBL3111835 0.82 DRD2 (0.47) TRPV1SLC6A9
SCHEMBL4297282 0.80 MEN1 (0.58) TRPV1NPY5R
Bromide SCHEMBL1593622 0.79 MEN1 (0.57) TRPV1NPY5R
SCHEMBL30685627 0.78 HTT (0.46) EPHX2
SCHEMBL30685636 0.78 ATM (0.47) ATM

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
US-5272157-A Derivatives of 4-(aminomethyl) piperidine, their preparation and their therapeutic application SYNTHELABO (FR) 1993-12-21 US disclosed
US-5179108-A Antiserotonin agents or cardiovascular disorders SYNTHELABO (FR) 1993-01-12 US disclosed