SCHEMBL23316767

SCHEMBL23316767

CN(CC1(NC=O)CC(c2cccc(F)c2)(N(C)C)C1)c1ccc(OC(F)(F)F)cn1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 18/20 0.50
▸ OPRM1 P35372 15/20 0.50
▸ MCHR1 Q99705 1/20 0.32

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
SCHEMBL23316769 0.80 OPRL1 (0.53) OPRL1OPRM1
SCHEMBL20653758 0.73 OPRM1 (0.54) OPRL1OPRM1MCHR1
SCHEMBL20653851 0.72 SLC6A4 (0.46) OPRL1OPRM1
SCHEMBL20653757 0.69 OPRM1 (0.43) OPRL1OPRM1MCHR1
SCHEMBL20647583 0.68 OPRL1 (0.69) OPRL1OPRM1
SCHEMBL20640157 0.68 OPRL1 (0.69) OPRL1OPRM1
SCHEMBL20647620 0.68 OPRL1 (0.58) OPRL1OPRM1
SCHEMBL20647543 0.67 OPRL1 (1.00) OPRL1OPRM1
SCHEMBL20640150 0.67 OPRL1 (1.00) OPRL1OPRM1
SCHEMBL20640218 0.66 OPRL1 (1.00) OPRL1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3652157-B1 1,3-DIAZA-SPIRO-[3.4]-OCTANE DERIVATIVES GRUENENTHAL GMBH (DE) 2021-05-05 — — EP disclosed
Send feedback