Phenol

Phenol

SCHEMBL8033747

C=CC(=O)OC1CC2CCC1(C)C2(C)C.Oc1ccccc1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.66
MAPT P10636 4/20 0.61
KMT2A Q03164 3/20 0.61
MAPK1 P28482 2/20 0.61
ELANE P08246 2/20 0.55
NPSR1 Q6W5P4 2/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
XBP1 P17861 1/20 0.53
CYP19A1 P11511 2/20 0.48
MEN1 O00255 2/20 0.44
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43

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
4-Vinylphenol SCHEMBL6757441 0.91 CYP2C19 (0.65) CYP2C19MAPTKMT2AMAPK1ELANE
Toluene SCHEMBL28069668 0.91 CYP2C19 (0.66) CYP2C19MAPTKMT2AMAPK1ELANE
Styrene SCHEMBL6757449 0.89 CYP2C19 (0.71) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL14110113 0.88 CYP2C19 (0.60) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL14110114 0.88 CYP2C19 (0.60) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL22902902 0.87 CYP2C19 (0.59) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL15778738 0.87 CYP2C19 (0.59) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL21838264 0.87 CYP2C19 (0.59) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL9227026 0.87 CYP2C19 (0.59) CYP2C19MAPTKMT2AMAPK1ELANE
SCHEMBL17917072 0.87 CYP2C19 (0.59) CYP2C19MAPTKMT2AMAPK1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6077643-A MICROELECTRONIC WAFER SUBSTRATE SHIPLEY COMPANY, L.L.C. (US) 2000-06-20 US disclosed