SCHEMBL8648337

SCHEMBL8648337

CC(NC(=O)c1ccc(C(=N)N)cc1)C(=O)N1CC[CH]CC1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.65
ITGA2B P08514 17/20 0.65
F2 P00734 1/20 0.44
F10 P00742 1/20 0.44
PRSS1 P07477 1/20 0.44

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
SCHEMBL8692845 0.85 ITGB3 (0.74) ITGB3ITGA2B
SCHEMBL8650532 0.84 ITGB3 (0.63) ITGB3ITGA2B
SCHEMBL27460974 0.84 ITGB3 (0.63) ITGB3ITGA2B
SCHEMBL7330638 0.81 ITGB3 (0.69) ITGB3ITGA2B
SCHEMBL8648608 0.81 ITGB3 (0.72) ITGB3ITGA2BF2F10PRSS1
SCHEMBL8693074 0.81 ITGB3 (0.72) ITGB3ITGA2BF2F10PRSS1
SCHEMBL8647567 0.80 MEN1 (0.51) ITGB3ITGA2BPRSS1
SCHEMBL7331297 0.79 ITGB3 (1.00) ITGB3ITGA2B
Iodide SCHEMBL9225689 0.78 ITGB3 (0.98) ITGB3ITGA2B
SCHEMBL8689455 0.78 ITGB3 (0.47) ITGB3ITGA2BF2F10PRSS1

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
US-5726185-A BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION HOFFMANN-LA ROCHE INC. (US) 1998-03-10 US disclosed