SCHEMBL7473365

SCHEMBL7473365

CCOC(=O)CC1CCN(C(=O)C(CC)C(C)(C)NC(=O)c2ccc(C#N)cc2F)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 16/20 0.52
ITGA2B P08514 16/20 0.52
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL7478359 0.93 ITGB3 (0.46) ITGB3ITGA2BSMN1; SMN2ALDH1A1MAPT
SCHEMBL7361345 0.86 ITGB3 (0.44) ITGB3ITGA2BSMN1; SMN2ALDH1A1MAPT
SCHEMBL7471266 0.85 ITGB3 (0.71) ITGB3ITGA2B
SCHEMBL7472139 0.84 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL7470113 0.83 ITGB3 (0.72) ITGB3ITGA2B
SCHEMBL7468977 0.83 ITGB3 (0.72) ITGB3ITGA2B
SCHEMBL7469311 0.82 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL7472244 0.81 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL7464123 0.81 ITGB3 (0.67) ITGB3ITGA2B
SCHEMBL7468256 0.79 ITGB3 (0.66) ITGB3ITGA2B

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-0852225-B1 FIBRINOGEN RECEPTOR ANTAGONISTS AND MEDICINAL PREPARATIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT NIPPON STEEL CORP (JP) 2002-10-30 EP disclosed
US-5866592-A Fibrinogen receptor antagonist and pharmaceutical compositions comprising the same NIPPON STEEL CORPORATION (JP) 1999-02-02 US disclosed
EP-0852225-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND MEDICINAL PREPARATIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT NIPPON STEEL CORPORATION (JP) 1998-07-08 EP disclosed