SCHEMBL7663628

SCHEMBL7663628

COC(=O)[C@H](CNC(=O)c1ccc2c(cnn2CCc2cc(N)nc(N)n2)c1)NS(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 20/20 0.55
▸ ITGAV P06756 20/20 0.55
▸ ITGA2B P08514 20/20 0.55

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
SCHEMBL7655641 0.93 ITGB3 (0.63) ITGB3ITGAVITGA2B
SCHEMBL7663330 0.75 ITGB3 (0.62) ITGB3ITGAVITGA2B
SCHEMBL7659775 0.75 ITGB3 (0.58) ITGB3ITGAVITGA2B
SCHEMBL7660910 0.74 PLA2G4A (0.43) —
SCHEMBL7432299 0.73 ALDH1A1 (0.39) —
SCHEMBL7980563 0.71 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7663435 0.70 ITGAV (0.62) ITGB3ITGAVITGA2B
SCHEMBL7656181 0.70 ITGB3 (0.53) ITGB3ITGAVITGA2B
SCHEMBL7349374 0.70 ITGB3 (0.70) ITGB3ITGAVITGA2B
SCHEMBL14271494 0.70 ITGB3 (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6489333-B2 HETEROCYCLIC COMPOUNDS CONTAINING A GUANIDINE MIMIC, FOR INHIBITION OF CELL ADHESION, TREATMENT OF ANGIOGENESIS DISORDERS, INFLAMMATION, CANCER METASTASIS, DIABETIC RETINOPATHY, THROMBOSIS, RESTENOSIS, MACULAR DEGENERATION BRISTOL - MEYERS SQUIBB PHARMA COMPANY 2002-12-03 — — US disclosed
US-20010044535-A1 Integrin antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2001-11-22 — — 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-20010044535-A1 Integrin antagonists ITGB3, VCAM1, ITGB2 ITGB3 1/4885ITGAV 12/4885ITGA2B 6/4885

“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.

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