SCHEMBL13535046

SCHEMBL13535046

Cc1cc(OCCCC2CCNCC2)cc(C)c1C(=O)NC(C)(C)CN

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 18/20 0.41
▸ ITGA2B P08514 18/20 0.41
▸ ITGAV P06756 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36

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
SCHEMBL12106777 0.86 ITGB3 (0.41) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL10044105 0.81 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL4397975 0.81 ITGB3 (0.50) ITGB3ITGA2BITGAVCHRM2SLC6A4
Hydrochloric Acid SCHEMBL1295959 0.79 ITGB3 (0.49) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL1296176 0.79 GPR119 (0.49) CHRM2
SCHEMBL13534979 0.79 ITGB3 (0.45) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL1295295 0.79 GPR119 (0.44) —
SCHEMBL10044115 0.77 ITGB3 (0.41) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL12106778 0.77 ITGB3 (0.41) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL12106771 0.77 ITGB3 (0.41) ITGB3ITGA2BITGAVCHRM2SLC6A4

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
WO-2010004343-A1 PIPERIDINYL GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-14 — — WO disclosed
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