Sugi Predict

Sugi Predict / Compounds / SCHEMBL362499

SCHEMBL362499

SCHEMBL362499

Cc1cc(Cl)ccc1C(C/C(=N\O)c1c[nH]c(=O)c(C)c1)c1ccc(OS(C)(=O)=O)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ GPBAR1 Q8TDU6 2/20 0.30

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
SCHEMBL364251 0.85 MEN1 (0.35) GPBAR1
SCHEMBL1389771 0.83 GPBAR1 (0.33) PPARGPPARAGPBAR1
SCHEMBL1389768 0.83 GPBAR1 (0.33) PPARGPPARAGPBAR1
SCHEMBL363394 0.83 MRGPRX4 (0.40) PPARGGPBAR1
SCHEMBL363129 0.83 FFAR1 (0.34) GPBAR1
SCHEMBL361734 0.81 GPBAR1 (0.34) GPBAR1
SCHEMBL365294 0.81 GPBAR1 (0.35) GPBAR1
SCHEMBL365274 0.80 GPBAR1 (0.46) GPBAR1
SCHEMBL363628 0.78 ADRB1 (0.35) GPBAR1
SCHEMBL363288 0.78 GPBAR1 (0.39) GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 — — EP claimed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 — — WO claimed
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 — — EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 — — WO disclosed