SCHEMBL5155939

SCHEMBL5155939

CN1Cc2cc(C(=O)O)ccc2N(C)C(CC(=O)O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 0.41
ITGAV P06756 14/20 0.41
ITGA2B P08514 12/20 0.41
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL7544674 0.87 ITGB3 (0.39) ITGB3ITGAVITGA2BMAPTHPGD
SCHEMBL7485250 0.86 ITGB3 (0.38) ITGB3ITGA2BLMNAMAPTHPGD
SCHEMBL7919362 0.85 ITGB3 (0.35) ITGB3ITGAVITGA2B
SCHEMBL7919341 0.85 BRD4 (0.41) ITGB3ITGAVITGA2BLMNAHPGD
SCHEMBL7668386 0.83 ITGB3 (0.42) ITGB3ITGAVITGA2BLMNAMAPT
SCHEMBL7397564 0.82 ITGB3 (0.47) ITGB3ITGAVITGA2B
SCHEMBL7397566 0.82 ITGB3 (0.47) ITGB3ITGAVITGA2B
SCHEMBL8525562 0.82 ITGB3 (0.39) ITGB3ITGAVITGA2BMAPT
SCHEMBL7910284 0.82 ITGB3 (0.39) ITGB3ITGAVITGA2BMAPT
SCHEMBL7366878 0.81 ITGB3 (0.38) ITGB3ITGAVITGA2BMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1420792-A4 PRODUCTS AND DRUG DELIVERY VEHICLES SMITHKLINE BEECHAM CORP (US) 2007-10-10 EP disclosed
EP-1341497-A4 RECEPTOR ANTAGONIST-LIPID CONJUGATES AND DELIVERY VEHICLES CONTAINING SAME SMITHKLINE BEECHAM CORP (US) 2005-10-19 EP disclosed
US-20040208844-A1 Products and drug delivery vehicles SMITHKLINE BEECHAM CORPORATION 2004-10-21 US disclosed
EP-1420792-A2 PRODUCTS AND DRUG DELIVERY VEHICLES SmithKline Beecham Corporation (US) 2004-05-26 EP disclosed
US-20040013720-A1 Receptor antagonist-lipid conjugates and delivery vehicles containing same SMITHKLINE BEECHAM CORPORATION 2004-01-22 US disclosed
EP-1341497-A2 RECEPTOR ANTAGONIST-LIPID CONJUGATES AND DELIVERY VEHICLES CONTAINING SAME SmithKline Beecham Corporation (US) 2003-09-10 EP disclosed
WO-2003011226-A2 PRODUCTS AND DRUG DELIVERY VEHICLES SMITHKLINE BEECHAM CORPORATION (US) 2003-02-13 WO disclosed
EP-0767792-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP disclosed
WO-2002036073-A2 RECEPTOR ANTAGONIST-LIPID CONJUGATES AND DELIVERY VEHICLES CONTAINING SAME SMITHKLINE BEECHAM CORPORATION (US) 2002-05-10 WO disclosed
EP-0767792-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-04-16 EP disclosed
WO-1996000730-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-01-11 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 (2 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-20040013720-A1 Receptor antagonist-lipid conjugates and delivery vehicles containing same LDLR, LPAR2, LPAR1 ITGB3 1479/4885ITGAV 869/4885ITGA2B 914/4885
US-20040208844-A1 Products and drug delivery vehicles ABCB1, DDT, CHMP4B ITGB3 2041/4885ITGAV 37/4885ITGA2B 993/4885

“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.