SCHEMBL7755174

SCHEMBL7755174

CC1CNCCC1(C)c1cccc(NS(=O)(=O)Cc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.41
OPRK1 P41145 1/20 0.41
FSHR P23945 1/20 0.41
BRD4 O60885 2/20 0.41
CYP19A1 P11511 1/20 0.40
HDAC1 Q13547 1/20 0.39
BRAF P15056 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38
PGR P06401 1/20 0.37
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL6653711 0.88 OPRM1 (0.47) OPRM1OPRK1BRD4KMT2AALDH1A1
SCHEMBL6653714 0.88 OPRM1 (0.47) OPRM1OPRK1BRD4KMT2AALDH1A1
SCHEMBL7757867 0.85 OPRM1 (0.44) OPRM1OPRK1BRD4KMT2ANPC1
SCHEMBL6656375 0.85 OPRM1 (0.44) OPRM1OPRK1BRD4KMT2ANPC1
SCHEMBL7756051 0.85 OPRM1 (0.44) OPRM1OPRK1BRD4KMT2ANPC1
SCHEMBL6659963 0.83 OPRM1 (0.43) OPRM1OPRK1BRD4ALDH1A1
SCHEMBL6659961 0.83 OPRM1 (0.43) OPRM1OPRK1BRD4ALDH1A1
SCHEMBL7754596 0.77 PKM (0.45) OPRM1HDAC1KMT2AHPGDALDH1A1
SCHEMBL7755278 0.77 OPRM1 (0.36) OPRM1OPRK1
SCHEMBL6527559 0.76 OPRM1 (0.39) OPRM1OPRK1

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-1077940-A1 4-PHENYLPIPERIDINES FOR THE TREATMENT OF PRURITIC DERMATOSES PFIZER INC. (US) 2001-02-28 EP disclosed
WO-1999059971-A1 NOVEL 4-PHENYLPIPERIDINES FOR THE TREATMENT OF PRURITIC DERMATOSES PFIZER INC. (US) 1999-11-25 WO disclosed