SCHEMBL25856478

SCHEMBL25856478

CC(C)C1CCC(CN2CCC(N3CC(N)C3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 17/20 0.39
OPRM1 P35372 15/20 0.39
OPRK1 P41145 13/20 0.39
OPRD1 P41143 7/20 0.39
ACHE P22303 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL3238744 0.87 CHRM5 (0.39) OPRL1OPRM1OPRK1OPRD1ACHE
Hydrochloric Acid SCHEMBL3230095 0.85 CHRM5 (0.38) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL25856483 0.82 OPRL1 (0.39) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL21947721 0.80 ACHE (0.40) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL27425161 0.80 ACHE (0.45) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL25630859 0.78 OPRL1 (0.43) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL680627 0.78 ACHE (0.47) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL29307076 0.75 CHRM5 (0.38) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL25605614 0.74 OPRL1 (0.39) OPRL1OPRM1OPRK1OPRD1ACHE
SCHEMBL21450690 0.73 CHRM5 (0.59) OPRL1OPRM1OPRK1OPRD1ACHE

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-2023131167-A1 COMPOUND FOR INHIBITING AND DEGRADING IRAK4, AND PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF 海思科医药集团股份有限公司 2023-07-13 WO disclosed