SCHEMBL7678053

SCHEMBL7678053

Cc1cc(C#CCNc2ccc(C(=N)N)cc2)c(Cl)cc1N(C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
F7 P08709 10/20 0.35
EGLN1 Q9GZT9 2/20 0.35
F2 P00734 8/20 0.33
PLAU P00749 1/20 0.33
HPN P05981 1/20 0.33
F10 P00742 2/20 0.32
PRSS1 P07477 2/20 0.32
TMPRSS15 P98073 2/20 0.32

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
SCHEMBL4250057 0.94 ITGB3 (0.38) ITGB3ITGA2BF7EGLN1F2
SCHEMBL6563515 0.90 F2 (0.36) ITGB3ITGA2BF7F2F10
SCHEMBL6563740 0.88 F7 (0.37) ITGB3ITGA2BF7EGLN1F2
SCHEMBL7674133 0.86 ITGB3 (0.36) ITGB3ITGA2BF7EGLN1F2
SCHEMBL6565377 0.85 ITGB3 (0.41) ITGB3ITGA2BF7F2PLAU
SCHEMBL6563086 0.85 F2 (0.39) ITGB3ITGA2BF7F2PLAU
SCHEMBL6565922 0.85 F7 (0.39) ITGB3ITGA2BF7EGLN1F2
SCHEMBL7675334 0.85 ITGB3 (0.38) ITGB3ITGA2BF7EGLN1F2
SCHEMBL7670888 0.84 F2 (0.38) ITGB3ITGA2BF7F2F10
SCHEMBL6565989 0.83 ITGB3 (0.36) ITGB3ITGA2BF7EGLN1F2

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-6479524-B1 TO PROLONG THE THROMBIN TIME BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-11-12 US disclosed