SCHEMBL31370441

SCHEMBL31370441

Cc1cc(C[C@@H](C(=O)O)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.41
FABP7 O15540 2/20 0.41
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
EPHX2 P34913 1/20 0.35
KMT2A Q03164 2/20 0.34
CASP3 P42574 1/20 0.34
PTPN1 P18031 2/20 0.34

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
SCHEMBL31370240 0.92 FABP5 (0.41) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25357124 0.92 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL30686136 0.92 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL24633948 0.92 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25360654 0.92 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25360820 0.91 ITGB3 (0.39) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25360816 0.91 ITGB3 (0.39) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL21994733 0.89 FABP5 (0.40) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL21994734 0.89 FABP5 (0.40) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL21838090 0.87 ADAMTS5 (0.43) FABP5FABP7ITGB3ITGA2BPPARG

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 FABP5 424/4885FABP7 508/4885ITGB3 4142/4885

“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.