SCHEMBL7447387

SCHEMBL7447387

O=C1NCc2ccccc2N1C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.69
OPRM1 P35372 3/20 0.69
OPRK1 P41145 2/20 0.69
CHRM3 P20309 3/20 0.53
DRD2 P14416 3/20 0.49
DRD4 P21917 3/20 0.49
DRD3 P35462 3/20 0.49
CHRM2 P08172 2/20 0.47
ACHE P22303 4/20 0.46
OXTR P30559 1/20 0.46
AVPR1A P37288 1/20 0.46

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
SCHEMBL3073412 0.84 OPRL1 (0.60) OPRL1OPRM1OPRK1CHRM3DRD2
SCHEMBL181682 0.82 OPRM1 (1.00) OPRL1OPRM1OPRK1
SCHEMBL13801271 0.79 OXTR (0.46) OPRL1OPRM1OPRK1OXTRAVPR1A
SCHEMBL3959841 0.78 OXTR (0.53) OXTRAVPR1A
SCHEMBL5768740 0.76 HTR2C (0.48) OPRL1OPRM1OPRK1OXTRAVPR1A
SCHEMBL14486768 0.76 OPRM1 (0.52) OPRL1OPRM1OPRK1OXTRAVPR1A
SCHEMBL14410177 0.76 OXTR (0.47) OPRL1OPRM1OPRK1OXTRAVPR1A
SCHEMBL1859464 0.75 OPRL1 (0.86) OPRL1OPRM1OPRK1
SCHEMBL13651197 0.75 OPRL1 (0.87) OPRL1OPRM1OPRK1DRD2DRD4
SCHEMBL7902547 0.75 OPRL1 (0.56) OPRL1OPRM1OPRK1CHRM3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714299-B1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2002-04-24 EP disclosed
US-5767118-A 4-Heterocyclic peperidines promote release of growth hormone MERCK & CO., INC. (US) 1998-06-16 US disclosed
EP-0785784-A4 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 1998-03-11 EP disclosed
US-5665719-A Benzoxazinone and benzopyrimidinone piperidinyl tocolytic oxytocin receptor antagonists MERCK & CO., INC. (US) 1997-09-09 US disclosed
EP-0785784-A1 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE Merck & Co., Inc. (US) 1997-07-30 EP disclosed
EP-0714299-A4 1996-07-10 EP disclosed
EP-0714299-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1996-06-05 EP disclosed
WO-1996013265-A1 4-HETEROCYCLIC PIPERIDINES PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1996-05-09 WO disclosed
WO-1995002405-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
EP-0029707-B1 NOVEL PIPERIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KYOWA HAKKO KOGYO CO., LTD (JP) 1984-02-01 EP disclosed
US-4344948-A HYPOTENSIVE AGENTS KYOWA HAKKO KOGYO CO., LTD. (JP) 1982-08-17 US disclosed
EP-0029707-A1 Novel piperidine derivatives, method for the preparation thereof and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD (JP) 1981-06-03 EP disclosed