SCHEMBL26892102

SCHEMBL26892102

O=C(O)CCC1C[C@@H]2C[C@@H](C(=O)N3CCC(Cc4ccc5c(n4)NCCC5)CC3)C[C@H]1N2

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.48
ITGAV P06756 20/20 0.48
ITGB5 P18084 17/20 0.48
ITGB1 P05556 1/20 0.48
ITGA2B P08514 3/20 0.46

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
SCHEMBL20487742 0.80 ITGAV (0.52) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL23542465 0.80 ITGAV (0.50) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL20481090 0.80 ITGAV (0.52) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL23542464 0.80 ITGAV (0.50) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL20481336 0.79 ITGAV (0.48) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL20481337 0.79 ITGAV (0.48) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL20481335 0.79 ITGAV (0.48) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL20480993 0.78 ITGAV (0.49) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL7095934 0.78 ITGB3 (0.51) ITGB3ITGAVITGB5ITGB1ITGA2B
SCHEMBL7098375 0.78 ITGAV (0.50) ITGB3ITGAVITGB5ITGB1ITGA2B

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-11827621-B2 Inhibitors of (α-v)(β-6) integrin MORPHIC THERAPEUTIC, INC. (US) 2023-11-28 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-11827621-B2 Inhibitors of (α-v)(β-6) integrin ITGB6, ITGA6, ITGAV ITGB3 12/4885ITGAV 3/4885ITGB5 15/4885

“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.