SCHEMBL6587601

SCHEMBL6587601

CCOC(=O)C1CN(CC2CCCCCCC2)CCC1n1c(=O)n(CCN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 16/20 0.51
OPRM1 P35372 15/20 0.51
OPRK1 P41145 5/20 0.51
TACR1 P25103 1/20 0.43
OGFRL1 Q5TC84 2/20 0.35
OPRD1 P41143 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL6585514 1.00 OPRL1 (0.51) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6585417 1.00 OPRL1 (0.51) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6585509 1.00 OPRL1 (0.51) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6585420 1.00 OPRL1 (0.51) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6582289 0.86 OPRL1 (0.59) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6586300 0.86 OPRL1 (0.58) OPRL1OPRM1OPRK1TACR1CYP2D6
SCHEMBL4919830 0.85 OPRL1 (0.69) OPRL1OPRM1OPRK1TACR1OGFRL1
SCHEMBL6583221 0.75 OPRL1 (0.54) OPRL1OPRM1OPRK1
SCHEMBL4916517 0.74 OPRL1 (0.58) OPRL1OPRM1OPRK1CYP2D6
SCHEMBL6586061 0.74 OPRL1 (0.58) OPRL1OPRM1OPRK1CYP2D6

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