SCHEMBL6777525

SCHEMBL6777525

CNC(=O)N(c1cccc(-c2ccc(C[C@@H](NS(=O)(=O)c3c(C)cc(C)cc3C)C(=O)O)cc2)c1)c1ccccn1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.60
ITGAV P06756 20/20 0.60
ALB P02768 2/20 0.53
ITGA2B P08514 2/20 0.53

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
SCHEMBL6777530 0.82 ITGB3 (0.68) ITGB3ITGAVALBITGA2B
SCHEMBL5878358 0.78 ITGB3 (0.72) ITGB3ITGAVALBITGA2B
SCHEMBL5878281 0.78 ITGB3 (0.65) ITGB3ITGAVALBITGA2B
SCHEMBL7660387 0.78 ITGB3 (0.65) ITGB3ITGAVALBITGA2B
SCHEMBL5878216 0.76 ITGB3 (0.75) ITGB3ITGAVALBITGA2B
SCHEMBL5878224 0.76 ITGB3 (0.75) ITGB3ITGAVALBITGA2B
SCHEMBL5878269 0.76 ITGB3 (0.69) ITGB3ITGAVALBITGA2B
SCHEMBL5878507 0.75 ITGB3 (0.75) ITGB3ITGAVALBITGA2B
SCHEMBL5878484 0.75 ITGB3 (1.00) ITGB3ITGAVALBITGA2B
SCHEMBL5878487 0.75 ITGB3 (1.00) ITGB3ITGAVALBITGA2B

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-6677360-B2 TREATMENT AND PROPHYLAXIS OF CANCER, ARTERIOSCLEROSIS, RESTENOSIS, OSTEOPOROSIS AND EYE DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 2004-01-13 US disclosed
US-20020016461-A1 Biphenyl and biphenyl-analogous compounds as integrin antagonists BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2002-02-07 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-20020016461-A1 Biphenyl and biphenyl-analogous compounds as integrin antagonists ITGB1, ITGB2, ITGB3 ITGB3 3/4885ITGAV 13/4885ALB 4149/4885

“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.