SCHEMBL29870204

SCHEMBL29870204

FC(F)CCNCCCCc1ccc2c(n1)N=CCC2

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 1/20 0.30
ITGA5 P08648 1/20 0.30
ITGB6 P18564 1/20 0.30

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
SCHEMBL29870058 0.90
SCHEMBL28505446 0.68 ITGAV (0.36) ITGAVITGA5ITGB6
SCHEMBL28502141 0.60 ITGAV (0.36) ITGAVITGA5ITGB6
SCHEMBL29461158 0.58 ITGAV (0.33) ITGAVITGB6
SCHEMBL21953899 0.58 ITGAV (0.56) ITGAVITGA5ITGB6
SCHEMBL22893672 0.55 ITGAV (0.58) ITGAVITGB6
SCHEMBL29416481 0.54 ITGAV (0.56) ITGAVITGB6
SCHEMBL22893606 0.54 ITGAV (0.56) ITGAVITGB6
SCHEMBL21328584 0.52 ITGAV (0.60) ITGAVITGB6
SCHEMBL23544602 0.51

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-11419869-B2 Dosage forms and regimens for amino acid compounds PLIANT THERAPEUTICS, INC. (US) 2022-08-23 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-11419869-B2 Dosage forms and regimens for amino acid compounds ITGB6, ITGA6, ITGAV ITGAV 3/4885ITGA5 4/4885ITGB6 1/4885

“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.