SCHEMBL23798653

SCHEMBL23798653

NC(=O)CN1C(=O)C2(CCC(N3CCC(NC=O)C3)CC2)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 19/20 0.49
OPRM1 P35372 2/20 0.44
OPRK1 P41145 1/20 0.44
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL23778393 0.88 OPRL1 (0.49) OPRL1OPRM1OPRK1ALDH1A1
SCHEMBL20073889 0.83 OPRL1 (0.49) OPRL1OPRM1OPRK1
SCHEMBL29709377 0.83 OPRL1 (0.49) OPRL1OPRM1OPRK1
SCHEMBL23778259 0.78 OPRL1 (0.45) OPRL1OPRM1OPRK1
SCHEMBL11636971 0.74 ALDH1A1 (0.54) OPRL1OPRM1OPRK1ALDH1A1
SCHEMBL23778457 0.72 ALDH1A1 (0.52) OPRL1OPRM1OPRK1ALDH1A1
SCHEMBL23798589 0.71 CHRM1 (0.43) OPRL1
SCHEMBL29709369 0.69 CHRM1 (0.44) OPRL1OPRM1OPRK1
SCHEMBL23799154 0.69 CHRM1 (0.44) OPRL1OPRM1OPRK1
SCHEMBL20073887 0.69 CHRM1 (0.44) OPRL1OPRM1OPRK1

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-3526207-B1 HETEROCYCLIC COMPOUNDS HAVING ACTIVITY AS MODULATORS OF MUSCARINIC M1 AND/OR M4 RECEPTORS IN THE TREATMENT OF CNS DISEASES AND PAINS. HEPTARES THERAPEUTICS LTD (GB) 2021-09-08 EP disclosed