SCHEMBL6582318

SCHEMBL6582318

CCn1c(=O)n(C2CCN(CC3CCCCCCC3)CC2CC=O)c2ccccc21

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 18/20 0.79
OPRM1 P35372 12/20 0.79
OPRK1 P41145 7/20 0.79
OPRD1 P41143 2/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL7739344 0.92 OPRL1 (0.68) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL6589497 0.90 OPRL1 (0.76) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL4919105 0.90 OPRL1 (0.85) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL4921253 0.88 OPRL1 (0.81) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL4921256 0.88 OPRL1 (0.81) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL6585745 0.88 OPRL1 (0.81) OPRL1OPRM1OPRK1OPRD1DRD2
J-113,397 SCHEMBL29623041 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1DRD2
J-113,397 SCHEMBL875219 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1DRD2
J-113,397 SCHEMBL6586337 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1DRD2
J-113,397 SCHEMBL4920647 0.88 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0990653-B1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-15 EP disclosed
US-6258825-B1 ANALGESIC, A RELIEVER AGAINST TOLERANCE TO A NARCOTIC ANALGESIC REPRESENTED BY MORPHINE, REMEDY FOR PARKINSONISM, A REMEDY FOR CHOREA, AN ANTIDEPRESSANT, A REMEDY FOR DIABETES INSIPIDUS, A REMEDY FOR POLYURIA, OR HYPOTENSION BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-07-10 US disclosed
EP-0990653-A1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed