SCHEMBL3413257

SCHEMBL3413257

Cc1cc(Cl)ccc1OCC(O)COc1ccc(-c2cccc(CC(=O)O)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 4/20 0.48
▸ MRGPRX4 Q96LA9 2/20 0.47
▸ SCN4A P35499 2/20 0.46
▸ FFAR1 O14842 3/20 0.44
▸ PPARG P37231 3/20 0.44
▸ PPARA Q07869 1/20 0.44
▸ SHMT1 P34896 1/20 0.43
▸ SHMT2 P34897 1/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ PTGER1 P34995 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.42
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ ANO1 Q5XXA6 1/20 0.42

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
SCHEMBL3418795 0.90 PPARD (0.47) PPARDMRGPRX4SHMT1SHMT2TBXA2R
SCHEMBL3410463 0.89 MRGPRX4 (0.46) PPARDMRGPRX4SCN4AFFAR1PPARG
SCHEMBL3416365 0.88 CYP1A2 (0.50) MRGPRX4FFAR1PPARGPPARASHMT1
SCHEMBL3419188 0.86 FFAR1 (0.47) PPARDMRGPRX4FFAR1PPARGPPARA
SCHEMBL3417537 0.86 KMT2A (0.46) PPARDFFAR1PPARGSHMT1SHMT2
SCHEMBL3411927 0.85 SCN9A (0.45) PPARDTBXA2RPTGER1PTPN11
SCHEMBL13433653 0.85 MEN1 (0.46) PPARDFFAR1PPARGTBXA2RPTGER1
SCHEMBL3416099 0.84 FFAR1 (0.52) PPARDFFAR1PPARGFFAR4NR1H2
SCHEMBL3418441 0.82 MEN1 (0.53) PPARDFFAR1PTPN11FFAR4NR1H2
SCHEMBL3411776 0.81 MEN1 (0.43) PPARDFFAR1PPARGTBXA2RPTGER1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-10-28 — — US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 — — EP 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-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR PPARD 689/4885MRGPRX4 975/4885SCN4A 423/4885

“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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