SCHEMBL2883767

SCHEMBL2883767

C=Cc1ccc(CCN(C)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESRRG P62508 1/20 0.39
▸ CTSK P43235 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ LTB4R Q15722 4/20 0.35
▸ LTB4R2 Q9NPC1 4/20 0.35
▸ PDK2 Q15119 1/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ MLYCD O95822 1/20 0.34
▸ GBA1 P04062 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33

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
SCHEMBL2237122 0.87 ESRRG (0.40) ESRRGCTSKLTB4RLTB4R2PDK2
SCHEMBL19878813 0.86 HTR2C (0.39) L3MBTL1HTR2CSLC6A4
SCHEMBL30264506 0.82 LTB4R (0.46) ESRRGCTSKL3MBTL1LTB4RLTB4R2
SCHEMBL2240309 0.82 PPARA (0.44) ESRRGCTSKLTB4RLTB4R2PDK2
SCHEMBL3015417 0.82 ESRRG (0.56) ESRRGL3MBTL1LTB4RLTB4R2PDK2
SCHEMBL30954590 0.81 AOC3 (0.47) ESRRGL3MBTL1PPARAPPARG
SCHEMBL21996922 0.81 ESRRG (0.42) ESRRGCTSKLTB4RLTB4R2PDK2
SCHEMBL22777273 0.81 ESRRG (0.42) ESRRGCTSKLTB4RLTB4R2PDK2
SCHEMBL1129151 0.81 TAAR1 (0.50) ESRRGCTSKLTB4RLTB4R2PDK2
SCHEMBL30954592 0.81 AOC3 (0.47) ESRRGL3MBTL1PPARAPPARG

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-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 — — US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 — — 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-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R ESRRG 1518/4885CTSK 2843/4885L3MBTL1 979/4885

“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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