SCHEMBL23950746

SCHEMBL23950746

N=C(N)NCCCC(NC(=O)c1ccc(O)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 10/20 0.50
▸ CA2 P00918 6/20 0.48
▸ C3AR1 Q16581 1/20 0.47
▸ CA1 P00915 3/20 0.47
▸ NPY4R P50391 3/20 0.45
▸ NPY1R P25929 2/20 0.45
▸ NPY2R P49146 2/20 0.45
▸ NPY5R Q15761 2/20 0.45

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
SCHEMBL5892488 0.90 FOLH1 (0.48) FOLH1CA2C3AR1CA1
SCHEMBL25158952 0.90 FOLH1 (0.48) FOLH1CA2C3AR1CA1
SCHEMBL188589 0.90 C3AR1 (0.52) FOLH1CA2C3AR1CA1
SCHEMBL7925397 0.90 C3AR1 (0.52) FOLH1CA2C3AR1CA1
SCHEMBL188590 0.90 C3AR1 (0.52) FOLH1CA2C3AR1CA1
SCHEMBL12971348 0.89 FOLH1 (0.62) FOLH1CA2C3AR1CA1
SCHEMBL12971349 0.89 FOLH1 (0.62) FOLH1CA2C3AR1CA1
SCHEMBL17104397 0.88 FOLH1 (0.47) FOLH1CA2C3AR1CA1
SCHEMBL17104389 0.88 TPSAB1 (0.47) FOLH1CA2C3AR1CA1
SCHEMBL17104379 0.88 FOLH1 (0.47) FOLH1CA2C3AR1CA1

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-20230148070-A1 AMINO ACID DERIVATIVES AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH SA (CH) 2023-05-11 — — US disclosed
WO-2021209345-A1 AMINO ACID DERIVATIVES AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH SA (CH) 2021-10-21 — — 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-20230148070-A1 AMINO ACID DERIVATIVES AND THEIR USE AS FLAVOR MODIFIERS GLUL, TAS2R5, ARGLU1 FOLH1 705/4885CA2 1522/4885C3AR1 3141/4885

“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.

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