SCHEMBL6431343

SCHEMBL6431343

CCOC(=O)[C@H](CCC(=O)CCCCc1ccc2c(n1)NCCCC2)c1cnc(OC)nc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 20/20 0.60
ITGB3 P05106 17/20 0.60
ITGB6 P18564 8/20 0.47
ITGB8 P26012 7/20 0.47
ITGB5 P18084 6/20 0.47

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
SCHEMBL6431348 1.00 ITGAV (0.60) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL5304862 0.98 ITGAV (0.63) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL5304869 0.98 ITGAV (0.63) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL5298439 0.90 ITGAV (0.61) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL5298453 0.90 ITGAV (0.61) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL5305490 0.89 ITGAV (0.72) ITGAVITGB3ITGB6ITGB8
SCHEMBL5305487 0.89 ITGAV (0.72) ITGAVITGB3ITGB6ITGB8
SCHEMBL27563545 0.87 ITGAV (0.55) ITGAVITGB3ITGB6ITGB8ITGB5
SCHEMBL6741101 0.84 ITGAV (0.67) ITGAVITGB3ITGB6ITGB8
SCHEMBL6741108 0.84 ITGAV (0.67) ITGAVITGB3ITGB6ITGB8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101593-A1 Phosphoric acid salt of an integrin receptor antagonist MEISSNER ROBERT S (US) 2005-05-12 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-20050101593-A1 Phosphoric acid salt of an integrin receptor antagonist ITGA5, ITGAL, ITGA2 ITGAV 12/4885ITGB3 5/4885ITGB6 16/4885

“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.