SCHEMBL31599676

SCHEMBL31599676

NC(=O)N1CCN(CC(F)F)CC12CC2

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.33
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31

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
SCHEMBL31599711 0.77 LTA4H (0.33) LTA4HOPRM1OPRD1OPRK1
SCHEMBL31599783 0.77 USP2 (0.35) OPRM1OPRD1OPRK1
SCHEMBL16440060 0.66
SCHEMBL17176304 0.64 OPRM1 (0.36) OPRM1OPRD1OPRK1
SCHEMBL28803040 0.61 OPRM1 (0.41) OPRM1OPRD1OPRK1
SCHEMBL15140812 0.61 PIK3CD (0.45) OPRM1OPRD1OPRK1
SCHEMBL31599560 0.61 LTA4H (0.31) LTA4H
SCHEMBL22090571 0.61
SCHEMBL22230119 0.61 HSD17B10 (0.45) OPRM1OPRD1OPRK1
SCHEMBL23479465 0.60

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
WO-2025111251-A1 COMPOUNDS THAT INHIBIT POLO-LIKE KINASE 4 EXELIXIS, INC. (US) 2025-05-30 WO disclosed