Phenol

Phenol

SCHEMBL28046169

CCCCOOC(C)(C)c1ccccc1.Oc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.48
ALDH1A1 P00352 3/20 0.42
ALOX15 P16050 1/20 0.42
ESR1 P03372 7/20 0.41
ESR2 Q92731 4/20 0.41
CYP3A4 P08684 2/20 0.41
LTA4H P09960 4/20 0.40
NR5A1 Q13285 1/20 0.40
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
TSHR P16473 3/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.37
RNASEL Q05823 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL166918 0.92 MAPK1 (0.57) MAPK1ALDH1A1ALOX15CYP3A4LTA4H
SCHEMBL720555 0.85 MAPK1 (0.53) MAPK1ALDH1A1ALOX15ESR1CYP3A4
SCHEMBL13438649 0.83 MAPK1 (0.41) MAPK1ALDH1A1ESR1ESR2CYP3A4
SCHEMBL11222460 0.81 MAPK1 (0.61) MAPK1ALDH1A1ALOX15CHRM2CHRM4
SCHEMBL28147725 0.80 MAPK1 (0.61) MAPK1ALDH1A1ALOX15ESR1CYP3A4
SCHEMBL3456096 0.80 MAPK1 (0.41) MAPK1ESR1ESR2LTA4HTSHR
Phenol SCHEMBL27505051 0.79 MAPK1 (0.77) MAPK1ALDH1A1ALOX15ESR1ESR2
SCHEMBL3862463 0.79 MAPK1 (0.59) MAPK1ALDH1A1ALOX15ESR1CYP3A4
SCHEMBL11590635 0.79 MAPK1 (0.59) MAPK1ALDH1A1ALOX15CYP3A4LTA4H
SCHEMBL13375856 0.78 MAPK1 (0.38) MAPK1LTA4HTSHRLMNACYP1A2

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
CN-103467730-B Carbamate compounds Asahi Kasei Chemical K. K. (JP) 2015-12-23 CN disclosed