SCHEMBL6673330

SCHEMBL6673330

CN(CCC1CCNCC1)C(=O)c1ccc2c(c1)CC(CC(=O)O)C(=O)N(CCC(C)(C)C)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 1.00
ITGA2B P08514 18/20 1.00
ITGAV P06756 2/20 0.46

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
SCHEMBL6673333 1.00 ITGB3 (1.00) ITGB3ITGA2BITGAV
SCHEMBL6949669 0.91 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6951354 0.91 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6673847 0.91 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6673855 0.91 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6675942 0.90 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6675093 0.90 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6945102 0.90 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6945079 0.90 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL6944818 0.89 ITGB3 (1.00) 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
WO-1995018619-A9 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-21 WO claimed
WO-1995018619-A9 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-21 WO disclosed
US-6117866-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-09-12 US disclosed