SCHEMBL3416273

SCHEMBL3416273

COc1ccc(-c2cccc(C(=O)O)c2)cc1C(=O)NCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 17/20 0.64
▸ PPARD Q03181 7/20 0.62
▸ PPARG P37231 7/20 0.62
▸ PSEN1 P49768 3/20 0.60
▸ PSEN2 P49810 3/20 0.60
▸ APH1B Q8WW43 3/20 0.60
▸ NCSTN Q92542 3/20 0.60
▸ APH1A Q96BI3 3/20 0.60
▸ PSENEN Q9NZ42 3/20 0.60

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
SCHEMBL5118153 0.90 PPARA (0.53) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL5974323 0.88 PPARA (0.72) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL13460899 0.85 PSEN1 (0.62) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL3415075 0.83 PPARD (0.79) PPARAPPARDPPARG
SCHEMBL2089153 0.80 PPARA (0.69) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL5974097 0.80 PPARA (0.80) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL5974498 0.79 PPARA (0.72) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6380273 0.78 PPARA (0.84) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6497829 0.78 PPARA (1.00) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL4663813 0.78 HPGD (0.72) PPARAPPARDPPARGPSEN1PSEN2

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 7 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-20080146612-A1 Novel Biaromatic Compounds, Inhibitors of the P2X7-Receptor ASTRAZENECA AB (SE) 2008-06-19 — — US disclosed
EP-1844003-A1 NOVEL BIAROMATIC COMPOUNDS, INHIBITORS OF THE P2X7-RECEPTOR AstraZeneca AB (SE) 2007-10-17 — — EP disclosed
WO-2006080884-A1 NOVEL BIAROMATIC COMPOUNDS, INHIBITORS OF THE P2X7-RECEPTOR ASTRAZENECA AB (SE) 2006-08-03 — — WO 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 (2 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-20080146612-A1 Novel Biaromatic Compounds, Inhibitors of the P2X7-Receptor P2RX2, P2RX1, ADORA1 PPARA 1339/4885PPARD 779/4885PPARG 800/4885
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR PPARA 130/4885PPARD 689/4885PPARG 238/4885

“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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