SCHEMBL17612803

SCHEMBL17612803

CC1(C)CCOc2c(Cl)cc(CCN3CCC4(CC3)CN(c3ccc(C(=O)O)cc3)C(=O)O4)cc21

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SSTR5 P35346 19/20 0.85
▸ OPRM1 P35372 1/20 0.52
▸ SIGMAR1 Q99720 1/20 0.52

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
SCHEMBL10283895 0.92 SSTR5 (1.00) SSTR5
SCHEMBL10283881 0.83 SSTR5 (1.00) SSTR5
SCHEMBL10283790 0.83 SSTR5 (1.00) SSTR5
SCHEMBL14963282 0.82 SSTR5 (0.82) SSTR5OPRM1SIGMAR1
SCHEMBL10284309 0.81 SSTR5 (0.81) SSTR5
SCHEMBL17612749 0.81 SSTR5 (0.81) SSTR5
SCHEMBL10283867 0.81 SSTR5 (1.00) SSTR5
SCHEMBL14957412 0.81 SSTR5 (0.79) SSTR5
SCHEMBL10283883 0.79 SSTR5 (0.77) SSTR5
SCHEMBL14957431 0.78 SSTR5 (0.77) SSTR5

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-2605658-B1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME (US) 2016-03-23 — — EP disclosed
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