SCHEMBL22923219

SCHEMBL22923219

COC(=O)[C@H](Cc1ccc(COCCc2ccc3c(n2)NCCC3)cc1)NC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 17/20 0.71
ITGB1 P05556 10/20 0.71
ITGA5 P08648 9/20 0.71
ITGB3 P05106 8/20 0.71
ITGB6 P18564 9/20 0.61
ITGA4 P13612 1/20 0.56

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
SCHEMBL20025236 0.92 ITGAV (0.83) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL20025264 0.92 ITGAV (0.83) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4245277 0.91 ITGAV (0.85) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4076675 0.88 ITGAV (0.73) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4067993 0.86 ITGB1 (0.72) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4066808 0.85 ITGAV (0.84) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL8226674 0.84 ITGAV (0.74) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4246243 0.84 ITGAV (0.72) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4252196 0.84 ITGB1 (0.71) ITGAVITGB1ITGA5ITGB3ITGB6
SCHEMBL4241327 0.83 ITGAV (1.00) ITGAVITGB1ITGA5ITGB3ITGB6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-11673887-B2 N-acyl amino acid compounds and methods of use PLIANT THERAPEUTICS, INC. (US) 2023-06-13 US disclosed
US-20210024516-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2021-01-28 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 (3 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-11673887-B2 N-acyl amino acid compounds and methods of use ITGA1, ITGB1, ITGAL ITGAV 4/4885ITGB1 2/4885ITGA5 6/4885
US-20210024516-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE ITGA1, ITGB1, ITGAL ITGAV 4/4885ITGB1 2/4885ITGA5 6/4885
US-20230365556-A1 N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE ITGA1, ITGB1, ITGAL ITGAV 4/4885ITGB1 2/4885ITGA5 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.