SCHEMBL6012734

SCHEMBL6012734

CN1CCC2(CC1)C(=O)NCC(=O)N2Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.48
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
OPRK1 P41145 2/20 0.48
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
CCR5 P51681 7/20 0.46
MC4R P32245 1/20 0.43
CXCR3 P49682 1/20 0.43
SLC6A9 P48067 2/20 0.41
BDKRB2 P30411 1/20 0.40

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
SCHEMBL6613810 0.90 BDKRB2 (0.46) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL6615174 0.89 OPRL1 (0.61) OPRL1OPRM1OPRD1OPRK1GSK3A
SCHEMBL6612028 0.87 LMNA (0.51) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL6012562 0.87 OPRL1 (0.52) OPRL1OPRM1OPRD1OPRK1GSK3A
SCHEMBL6613893 0.85 OPRM1 (0.48) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL6610245 0.84 CCR3 (0.51) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL6614791 0.84 OPRM1 (0.42) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL6012726 0.84 CXCR3 (0.59) OPRL1OPRM1OPRD1OPRK1CCR5
SCHEMBL7483160 0.83 CCR5 (0.52) CCR5
SCHEMBL6615585 0.83 CCR5 (0.52) CCR5

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
US-7119091-B2 Triazaspiro[5.5]undecane derivatives and pharmaceutical compositions comprising thereof, as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-10 US disclosed
EP-1236726-B1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2004-12-01 EP disclosed
EP-1236726-A1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-09-04 EP disclosed