SCHEMBL7795113

SCHEMBL7795113

CN(CC(=O)c1ccc(OCC(=O)O)c(OCC(=O)O)c1)C(=O)Cc1cccc(N)n1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.55
ITGA2B P08514 7/20 0.55
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LTB4R Q15722 8/20 0.39
LTB4R2 Q9NPC1 8/20 0.39
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ITGAV P06756 1/20 0.36
POLB P06746 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL7795621 0.87 LMNA (0.39) ITGB3ITGA2BMEN1KMT2ALTB4R
SCHEMBL7788854 0.86 ITGB3 (0.52) ITGB3ITGA2BMEN1KMT2ALTB4R
SCHEMBL7795117 0.81 ITGB3 (0.44) ITGB3ITGA2BMEN1KMT2ALTB4R
SCHEMBL7588938 0.77 LMNA (0.38) ITGB3ITGA2BITGAVPOLB
SCHEMBL7592919 0.75 LMNA (0.37) ITGB3ITGA2BLTB4R2POLB
SCHEMBL7796051 0.74 MAPK1 (0.43) LTB4RLTB4R2L3MBTL1POLB
SCHEMBL7499998 0.72 ITGB3 (0.55) ITGB3ITGA2BMEN1KMT2ALTB4R
SCHEMBL7796040 0.72 ITGB3 (0.40) ITGB3ITGA2BITGAVPOLB
SCHEMBL8381416 0.71 ITGB3 (1.00) ITGB3ITGA2BMEN1KMT2ALTB4R
SCHEMBL7798164 0.71 ITGB3 (0.61) ITGB3ITGA2BMEN1KMT2ALTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 US claimed
US-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 US disclosed
EP-0895475-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2000-08-23 EP disclosed
EP-0895475-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-10 EP disclosed
WO-1997024122-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 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-20010034445-A1 Vitronectin receptor antagonists ADGRF1, GPR174, CALCRL ITGB3 132/4885ITGA2B 106/4885MEN1 496/4885

“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.