SCHEMBL8136279

SCHEMBL8136279

CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2CCN)c2ccccc21.CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2CCO)c2ccccc21

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 16/20 0.78
OPRM1 P35372 10/20 0.78
OPRK1 P41145 5/20 0.78
SIGMAR1 Q99720 4/20 0.39
TMEM97 Q5BJF2 2/20 0.36
OPRD1 P41143 1/20 0.36

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
SCHEMBL6589245 0.95 OPRL1 (0.79) OPRL1OPRM1OPRK1OPRD1
SCHEMBL4915159 0.95 OPRL1 (0.85) OPRL1OPRM1OPRK1SIGMAR1TMEM97
SCHEMBL4918269 0.92 OPRL1 (0.76) OPRL1OPRM1OPRK1OPRD1
SCHEMBL4918155 0.90 OPRL1 (0.82) OPRL1OPRM1OPRK1SIGMAR1OPRD1
SCHEMBL4921253 0.88 OPRL1 (0.81) OPRL1OPRM1OPRK1OPRD1
J-113,397 SCHEMBL875219 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL4921256 0.88 OPRL1 (0.81) OPRL1OPRM1OPRK1OPRD1
J-113,397 SCHEMBL4920647 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
J-113,397 SCHEMBL6586337 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
J-113,397 SCHEMBL29623041 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1

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
EP-0990653-A1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed