SCHEMBL22814930

SCHEMBL22814930

CC(C)C(C)C1CCN(C2CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 13/20 0.40
OPRL1 P41146 13/20 0.40
OPRK1 P41145 9/20 0.38
OPRD1 P41143 4/20 0.35
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL25033288 0.86 HRH3 (0.38) OPRM1OPRL1CHRM2CHRM4CHRM5
SCHEMBL25090134 0.81 CHRM2 (0.30) OPRM1OPRL1CHRM2CHRM4CHRM5
SCHEMBL824131 0.80 OPRL1 (0.49) OPRM1OPRL1OPRK1OPRD1
SCHEMBL9976590 0.76 OPRM1 (0.50) OPRM1OPRL1OPRK1OPRD1CHRM2
SCHEMBL24585209 0.76 OPRM1 (0.54) OPRM1OPRL1OPRK1OPRD1
SCHEMBL12423917 0.76 OPRL1 (0.37) OPRM1OPRL1OPRK1OPRD1CHRM1
SCHEMBL14098626 0.75 NCF1 (0.37) OPRM1CHRM2CHRM1
SCHEMBL12398698 0.75 NCF1 (0.37) OPRM1CHRM2CHRM1
SCHEMBL12563449 0.75 NCF1 (0.37) OPRM1CHRM2CHRM1
SCHEMBL22874788 0.74 OPRM1 (0.49) OPRM1OPRL1OPRK1OPRD1CHRM2

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-2020252589-A1 IONIZABLE LIPIDS FOR NUCLEIC ACID DELIVERY Precision Nanosystems Inc. (CA) 2020-12-24 WO disclosed