SCHEMBL8170992

SCHEMBL8170992

CN1Cc2cc(C(=O)NCCNc3ncccn3)ccc2NC(CC(=O)O)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 1.00
ITGAV P06756 20/20 1.00
ITGA2B P08514 14/20 0.83

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
SCHEMBL7543841 0.88 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL8181057 0.84 ITGB3 (0.78) ITGB3ITGAVITGA2B
SCHEMBL8180742 0.83 ITGB3 (0.77) ITGB3ITGAVITGA2B
SCHEMBL7338737 0.81 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7496596 0.80 ITGB3 (0.72) ITGB3ITGAVITGA2B
SCHEMBL6677335 0.79 ITGB3 (0.68) ITGB3ITGAVITGA2B
SCHEMBL6677340 0.79 ITGB3 (0.68) ITGB3ITGAVITGA2B
SCHEMBL5972553 0.79 ITGB3 (0.68) ITGB3ITGAVITGA2B
SCHEMBL7333550 0.78 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL6948850 0.78 ITGB3 (0.78) ITGB3ITGAVITGA2B

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-6159964-A Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-12-12 US disclosed