SCHEMBL13744638

SCHEMBL13744638

CCOc1ccc(C[C@H](NC(=O)c2ccc(C(=N)N)cc2)C(=O)N2CCC(OCC(=O)O)CC2)cc1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 16/20 0.79
ITGA2B P08514 16/20 0.79
GAA P10253 1/20 0.48
RAB9A P51151 1/20 0.48
F10 P00742 2/20 0.45
F2 P00734 1/20 0.45
PLG P00747 1/20 0.45
PLAU P00749 1/20 0.45
ST14 Q9Y5Y6 1/20 0.45
KLKB1 P03952 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
SCHEMBL7292028 0.91 ITGB3 (0.82) ITGB3ITGA2BF10F2PLG
SCHEMBL7284349 0.91 ITGB3 (0.82) ITGB3ITGA2BF10F2PLG
SCHEMBL7276503 0.91 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL8880911 0.89 ITGB3 (0.78) ITGB3ITGA2B
Lamifiban SCHEMBL871446 0.88 ITGB3 (1.00) ITGB3ITGA2BF2PLG
Lamifiban SCHEMBL4683 0.88 ITGB3 (1.00) ITGB3ITGA2BF2PLG
SCHEMBL7282972 0.88 ITGB3 (0.86) ITGB3ITGA2BF10F2
SCHEMBL8379088 0.86 ITGB3 (0.78) ITGB3ITGA2B
SCHEMBL7294041 0.86 ITGB3 (0.78) ITGB3ITGA2B
SCHEMBL7293550 0.84 ITGB3 (0.68) ITGB3ITGA2BF10F2PLG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576071-B2 Antithrombotic compound SANOFI-AVENTIS (FR) 2009-08-18 US disclosed
US-20070293442-A1 ANTITHROMBOTIC COMPOUND SANOFI-AVENTIS (FR) 2007-12-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070293442-A1 ANTITHROMBOTIC COMPOUND F13B, SERPINC1, SELP ITGB3 66/4885ITGA2B 13/4885GAA 430/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.