SCHEMBL10312503

SCHEMBL10312503

Cc1ccc2cc(CCC(=O)O)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.57
FFAR4 Q5NUL3 5/20 0.57
CYP1A2 P05177 1/20 0.56
PPARG P37231 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PLA2G10 O15496 2/20 0.49

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
SCHEMBL9670503 0.89 CYP1A2 (0.67) FFAR1FFAR4CYP1A2
SCHEMBL20323255 0.86 CYP1A2 (0.66) FFAR1FFAR4CYP1A2ALDH1A1
SCHEMBL30403190 0.81 CYP1A2 (0.80) FFAR1FFAR4CYP1A2
SCHEMBL11479830 0.81 PTGS1 (0.64) FFAR1CYP1A2ALDH1A1
SCHEMBL1217683 0.81 CYP1A2 (0.80) FFAR1FFAR4CYP1A2
SCHEMBL12889161 0.81 CYP1A2 (0.59) FFAR1FFAR4CYP1A2PLA2G10
SCHEMBL169770 0.81 FFAR1 (0.79) FFAR1FFAR4ALDH1A1
SCHEMBL29921611 0.80 HCAR2 (0.57) FFAR1FFAR4CYP1A2
Hydrochloric Acid SCHEMBL27401796 0.80 CYP1A2 (0.77) FFAR1FFAR4CYP1A2
SCHEMBL151952 0.80 HCAR2 (0.57) FFAR1FFAR4CYP1A2

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
EP-4219443-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST Lg Chem, Ltd. (KR) 2023-08-02 EP disclosed
US-20120178750-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment MERCK SHARP & DOHME CORP. (US) 2012-07-12 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-20120178750-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment HCAR1, HCAR2, FFAR1 FFAR1 3/4885FFAR4 16/4885CYP1A2 623/4885

“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.