SCHEMBL7501339

SCHEMBL7501339

CN1Cc2cc(C(=O)N(CCC3CCNCC3)Cc3nc4ccccc4[nH]3)ccc2N[C@@H](CC(=O)O)C1=O

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.81
ITGAV P06756 20/20 0.81
ITGA2B P08514 3/20 0.73

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
SCHEMBL7510058 0.96 ITGB3 (0.81) ITGB3ITGAVITGA2B
SCHEMBL8325096 0.90 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7077079 0.88 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL6944353 0.88 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7918275 0.88 ITGB3 (0.92) ITGB3ITGAVITGA2B
SCHEMBL5165662 0.87 ITGB3 (0.86) ITGB3ITGAVITGA2B
SCHEMBL5972719 0.86 ITGB3 (0.85) ITGB3ITGAVITGA2B
SCHEMBL7367456 0.86 ITGB3 (0.65) ITGB3ITGAVITGA2B
SCHEMBL6130318 0.85 ITGB3 (0.84) ITGB3ITGAVITGA2B
SCHEMBL7509393 0.85 ITGB3 (0.85) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020055499-A1 Integrin receptor antagonists HEERDING DIRK (US) 2002-05-09 US disclosed
EP-1007051-A4 INTEGRIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2001-08-29 EP disclosed
EP-1007051-A1 INTEGRIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-06-14 EP disclosed
WO-1999006049-A1 INTEGRIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-11 WO 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-20020055499-A1 Integrin receptor antagonists ITGB1, ITGB2, ITGA1 ITGB3 8/4885ITGAV 14/4885ITGA2B 7/4885

“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.