SCHEMBL6578075

SCHEMBL6578075

COC(=O)N1CCC(N2CCC(n3c(=O)n(C(N)=O)c4ccccc43)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.49
CHRM4 P08173 1/20 0.49
CHRM5 P08912 1/20 0.49
CHRM1 P11229 1/20 0.49
CHRM3 P20309 1/20 0.49
OPRL1 P41146 11/20 0.48
OPRM1 P35372 9/20 0.47
OPRK1 P41145 2/20 0.46
OGFRL1 Q5TC84 2/20 0.46
OPRD1 P41143 2/20 0.45
KCNH2 Q12809 1/20 0.45
HSD11B1 P28845 1/20 0.43
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43

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
SCHEMBL6580155 0.92 CHRM1 (0.52) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6580420 0.90 CHRM2 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6580899 0.85 HSD11B1 (0.58) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6580319 0.82 OPRL1 (0.59) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6579971 0.82 OPRL1 (0.56) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6577964 0.81 CHRM1 (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6577940 0.81 CHRM1 (0.67) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6580114 0.81 OPRL1 (0.62) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6580289 0.81 OPRL1 (0.57) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6577945 0.81 OPRL1 (0.62) CHRM2CHRM4CHRM5CHRM1CHRM3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221443-B1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-01 EP claimed
US-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US claimed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP claimed
EP-1221443-B1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-01 EP disclosed
US-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed