SCHEMBL7312540

SCHEMBL7312540

CN(C(=O)C1CC1)C1(c2ccccc2)CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 17/20 0.51
OPRL1 P41146 16/20 0.51
OPRK1 P41145 2/20 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
SCHEMBL7314223 0.93 OPRL1 (0.48) OPRM1OPRL1OPRK1
SCHEMBL7750561 0.86 CYP2C19 (0.40) OPRM1OPRL1OPRK1
SCHEMBL4631671 0.83 OPRM1 (0.73) OPRM1OPRL1OPRK1
SCHEMBL27450087 0.83 OPRM1 (0.49) OPRM1OPRL1OPRK1
SCHEMBL7745677 0.81 ALDH1A1 (0.38) OPRM1OPRL1OPRK1
SCHEMBL7313869 0.81 OPRM1 (0.56) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL7478467 0.81 OPRM1 (0.69) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL7478459 0.81 OPRM1 (0.69) OPRM1OPRL1OPRK1
SCHEMBL4352116 0.80 OPRL1 (0.63) OPRM1OPRL1OPRK1
SCHEMBL4298027 0.79 OPRL1 (0.42) OPRM1OPRL1OPRK1

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-0673928-B1 Novel N-(3,4-dichlorophenyl-propyl)-piperidine derivatives as selective human NK3-receptor antagonists SANOFI SYNTHELABO (FR) 2001-08-29 EP disclosed
EP-0673928-A1 Novel N-(3,4-dichlorophenyl-propyl)-piperidine derivatives as selective human NK3-receptor antagonists SANOFI (FR) 1995-09-27 EP disclosed