SCHEMBL23699265

SCHEMBL23699265

CN(C)C1(c2ccccc2)CCN(C(=O)[C@H](CN)C(C)(C)c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 20/20 0.44
OPRL1 P41146 17/20 0.44
OPRK1 P41145 1/20 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
SCHEMBL23699266 1.00 OPRM1 (0.44) OPRM1OPRL1OPRK1
SCHEMBL23719008 0.78 OPRM1 (0.46) OPRM1OPRL1OPRK1
SCHEMBL23719065 0.78 OPRM1 (0.52) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL23699329 0.77 OPRM1 (0.45) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL23699330 0.77 OPRM1 (0.45) OPRM1OPRL1OPRK1
SCHEMBL23719114 0.77 OPRL1 (0.46) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL23699302 0.77 OPRM1 (0.51) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL23699445 0.76 OPRL1 (0.45) OPRM1OPRL1OPRK1
SCHEMBL23719096 0.75 ME2 (0.54) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL23699282 0.74 OPRM1 (0.47) 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-3858439-A1 AMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2021-08-04 EP claimed
EP-3858439-A1 AMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2021-08-04 EP disclosed