SCHEMBL14340823

SCHEMBL14340823

O=C(CCc1ccc(-c2cccc(CO)c2)cc1)Nc1ccccc1C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 19/20 0.79
▸ AKR1C3 P42330 1/20 0.62
▸ AKR1C2 P52895 1/20 0.62
▸ CYP2C8 P10632 1/20 0.58
▸ CYP2C9 P11712 1/20 0.58

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
SCHEMBL14340828 0.90 HCAR2 (0.77) HCAR2
SCHEMBL12671515 0.89 HCAR2 (0.89) HCAR2CYP2C8CYP2C9
SCHEMBL31060511 0.89 HCAR2 (0.89) HCAR2CYP2C8CYP2C9
SCHEMBL14340790 0.88 HCAR2 (1.00) HCAR2CYP2C8CYP2C9
SCHEMBL14340799 0.86 HCAR2 (1.00) HCAR2CYP2C8CYP2C9
SCHEMBL14340814 0.86 HCAR2 (1.00) HCAR2CYP2C8CYP2C9
SCHEMBL2275482 0.84 HCAR2 (0.71) HCAR2
SCHEMBL14340819 0.84 HCAR2 (1.00) HCAR2CYP2C8CYP2C9
SCHEMBL10497116 0.83 HCAR2 (0.78) HCAR2CYP2C8CYP2C9
SCHEMBL14340798 0.83 HCAR2 (0.75) HCAR2

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-20070281969-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment MERCK SHARP & DOHME CORP. 2007-12-06 — — US disclosed
US-20070281969-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment MERCK SHARP & DOHME CORP. 2007-12-06 — — 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-20070281969-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment GPR119, FFAR1, HCAR1 HCAR2 7/4885AKR1C3 87/4885AKR1C2 90/4885

“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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