SCHEMBL6583551

SCHEMBL6583551

O=C1CCN(CC2CCCCCCC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.61
ADRA2C P18825 1/20 0.61
ACHE P22303 1/20 0.53
OPRL1 P41146 7/20 0.49
OPRM1 P35372 6/20 0.49
OPRK1 P41145 4/20 0.49
OPRD1 P41143 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
SIGMAR1 Q99720 5/20 0.46
DRD2 P14416 2/20 0.46
TRPC5 Q9UL62 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
SCHEMBL3009112 1.00 CHRM5 (0.61) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL16102614 1.00 CHRM5 (0.61) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL1817532 0.89 CHRM5 (0.44) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL8108393 0.89 CHRM5 (0.44) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL25602930 0.83 CHRM5 (0.61) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL11438671 0.81 CHRM5 (0.58) CHRM5ADRA2CACHEOPRL1OPRM1
SCHEMBL16128219 0.80 EBP (0.42) CHRM5ADRA2C
SCHEMBL31333947 0.80 CHRM5 (0.38) CHRM5ADRA2COPRM1OPRK1OPRD1
SCHEMBL16098763 0.80 CHRM3 (0.43) CHRM5ADRA2CACHESIGMAR1DRD2
SCHEMBL11596303 0.79 CHRM5 (0.84) CHRM5ADRA2CACHEOPRL1OPRM1

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