Phenol

Phenol

SCHEMBL4706535

CCOC(=O)C(C)(C)Oc1ccccc1.Oc1ccccc1

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.63
ABCB11 O95342 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
TSHR P16473 1/20 0.63
HTR2A P28223 1/20 0.63
PMP22 Q01453 1/20 0.63
PPARG P37231 4/20 0.53
FBP1 P09467 8/20 0.51
PIN1 Q13526 1/20 0.46
MMP8 P22894 1/20 0.44
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL2824491 0.94 PPARA (0.71) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL199420 0.89 PPARA (0.73) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL197882 0.88 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL4428685 0.82 PPARG (0.61) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL10654872 0.82 PPARA (0.55) PPARAABCB11CYP1A2CYP3A4TSHR
Clofibrate SCHEMBL28086141 0.81 PPARA (0.94) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL3903999 0.80 PPARA (0.76) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL11548436 0.80 PPARA (0.76) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL5908170 0.80 PPARA (0.61) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14254637 0.79 PPARA (0.69) PPARAABCB11CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758582-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP disclosed
EP-1758582-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP disclosed
WO-2006002349-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-01-05 WO disclosed