SCHEMBL21635802

SCHEMBL21635802

CCCC[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)Cc1ccc(NC(=O)Nc2ccccc2C)cc1)C(=O)N[C@@H](CCC(=O)O)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 20/20 0.56
ITGA4 P13612 20/20 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
SCHEMBL21635811 0.94 ITGB1 (0.56) ITGB1ITGA4
SCHEMBL21635801 0.84 ITGB1 (0.61) ITGB1ITGA4
SCHEMBL7673466 0.82 ITGB1 (0.66) ITGB1ITGA4
SCHEMBL21635818 0.79 ITGB1 (0.58) ITGB1ITGA4
SCHEMBL24117491 0.79 ITGB1 (0.66) ITGB1ITGA4
SCHEMBL6178535 0.79 ITGB1 (0.55) ITGB1ITGA4
SCHEMBL13764096 0.78 ITGB1 (0.66) ITGB1ITGA4
SCHEMBL21635812 0.78 ITGB1 (0.54) ITGB1ITGA4
SCHEMBL21635751 0.77 ITGB1 (0.52) ITGB1ITGA4
SCHEMBL21635799 0.77 ITGB1 (0.48) ITGB1ITGA4

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-20210395302-A1 PEPTIDES FOR ACTIVATION OF CELL SIGNALING IN OSTEOPROGENITOR CELLS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-23 US disclosed
WO-2020018941-A1 PEPTIDES FOR ACTIVATION OF CELL SIGNALING IN OSTEOPROGENITOR CELLS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-01-23 WO 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-20210395302-A1 PEPTIDES FOR ACTIVATION OF CELL SIGNALING IN OSTEOPROGENITOR CELLS ITGB4, ITGA4, ITGB1 ITGB1 3/4885ITGA4 2/4885

“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.