SCHEMBL28564331

SCHEMBL28564331

NC(=O)C1(NCCC2CCC(c3cc(F)ccc3Cl)CC2)CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 20/20 1.00

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
SCHEMBL23974635 1.00 OPRL1 (1.00) OPRL1
SCHEMBL23974638 1.00 OPRL1 (1.00) OPRL1
SCHEMBL23974313 0.92 OPRL1 (1.00) OPRL1
SCHEMBL23974384 0.92 OPRL1 (1.00) OPRL1
SCHEMBL23974670 0.91 OPRL1 (1.00) OPRL1
SCHEMBL23974647 0.88 OPRL1 (1.00) OPRL1
SCHEMBL23974648 0.88 OPRL1 (1.00) OPRL1
SCHEMBL23974505 0.86 OPRL1 (1.00) OPRL1
SCHEMBL23974383 0.86 OPRL1 (1.00) OPRL1
SCHEMBL23974643 0.86 OPRL1 (1.00) OPRL1

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
CN-112105605-A Substituted cyclohexyl compounds as NOP inhibitors 达特神经科学有限公司 2020-12-18 CN disclosed