Phenol

Phenol

SCHEMBL28077940

C=CC(=O)O.C=CC(=O)OC(C)Oc1ccccc1.Oc1ccccc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
HCAR2 Q8TDS4 1/20 0.37
HPGD P15428 1/20 0.37
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
TSHR P16473 2/20 0.36
GAA P10253 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 2/20 0.34
CA12 O43570 1/20 0.34
AKR1B10 O60218 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
AKR1B1 P15121 1/20 0.34

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
Acrylic Acid SCHEMBL7185233 0.94 THRB (0.44) THRBHCAR2HPGDMTNR1AMTNR1B
Acrylic Acid SCHEMBL28252917 0.94 THRB (0.44) THRBHCAR2HPGDMTNR1AMTNR1B
SCHEMBL34034 0.91 THRB (0.46) THRBHCAR2HPGDMTNR1AMTNR1B
Water SCHEMBL28126876 0.90 THRB (0.45) THRBHCAR2HPGDMTNR1AMTNR1B
Paraben SCHEMBL28070554 0.88 KMT2A (0.45) THRBTSHRPKMALDH1A1KMT2A
SCHEMBL28010865 0.87 THRB (0.43) THRBHCAR2HPGDMTNR1AMTNR1B
SCHEMBL9771285 0.86 CA12 (0.41) THRBTSHRGAACYP1A2CYP2C9
Ethylene Glycol SCHEMBL7182341 0.85 THRB (0.45) THRBHCAR2HPGDMTNR1AMTNR1B
Anisole SCHEMBL29182465 0.85 CA4 (0.42) THRBMTNR1AMTNR1BTSHRGAA
Methacrylic Acid SCHEMBL20875122 0.84 THRB (0.41) THRBHCAR2HPGDMTNR1AMTNR1B

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-103242702-B Uv-curing type ink jet compositions and record thing 精工爱普生株式会社 2016-07-13 CN disclosed