SCHEMBL31370519

SCHEMBL31370519

CN[C@@H](Cc1c[nH]nn1)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
CPB2 Q96IY4 4/20 0.32
NAALAD2 Q9Y3Q0 1/20 0.31
CPB1 P15086 1/20 0.31

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
SCHEMBL304610 0.83 ITGA4 (0.39) NAALAD2
SCHEMBL304609 0.83 ITGA4 (0.39) NAALAD2
SCHEMBL13146680 0.83 NAALAD2 (0.31) NAALAD2
SCHEMBL3780424 0.79 ACE (0.48) PPARG
SCHEMBL18179443 0.78 APAF1 (0.40)
SCHEMBL846787 0.78 APAF1 (0.40)
SCHEMBL763106 0.76 KMT2A (0.30)
SCHEMBL23356105 0.75 CYP1A2 (0.50)
SCHEMBL12493834 0.75 CYP1A2 (0.50)
SCHEMBL4272240 0.75 CYP1A2 (0.50)

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 PPARG 3591/4885CPB2 1133/4885NAALAD2 87/4885

“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.