Phenol

Phenol

SCHEMBL9862153

C=CC=C.Oc1ccccc1.c1ccc(COCc2ccccc2)cc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
LMNA P02545 3/20 0.48
CYP1A2 P05177 2/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
CYP2C19 P33261 1/20 0.48
PTGS2 P35354 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HIF1A Q16665 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CA1 P00915 5/20 0.46
CA9 Q16790 4/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 2/20 0.46
CA4 P22748 2/20 0.46
CA14 Q9ULX7 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
GLA P06280 1/20 0.46
CA3 P07451 1/20 0.46
CA7 P43166 3/20 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
Butadiene SCHEMBL2164210 0.91 TSHR (0.75) TSHRCA1CA9CA2CA7
Phenol SCHEMBL5486172 0.89 TSHR (0.79) TSHRLMNACYP1A2PTGS1SLC6A2
Phenol SCHEMBL21518644 0.89 TSHR (0.79) TSHRLMNACYP1A2PTGS1SLC6A2
Phenol SCHEMBL28657771 0.87 TSHR (0.68) TSHRLMNACYP1A2PTGS1SLC6A2
Hydroquinone SCHEMBL51561 0.84 TSHR (0.79) TSHRLMNACYP1A2PTGS1SLC6A2
SCHEMBL1840533 0.82 TSHR (0.75) TSHRLMNACYP1A2PTGS1SLC6A2
Hydroquinone SCHEMBL7511716 0.82 TSHR (0.75) TSHRLMNACYP1A2PTGS1SLC6A2
Hydrogen Peroxide SCHEMBL28758135 0.82 TSHR (0.94) TSHRLMNACYP1A2PTGS1SLC6A2
Phenol SCHEMBL7763305 0.82 CA12 (0.69) TSHRLMNAHIF1ACA1CA9
Phenol SCHEMBL5469697 0.82 CA12 (0.69) TSHRLMNAHIF1ACA1CA9

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
JP-3092343-A None JP disclosed
JP-H0392343-A LAMINATED SHEET FOR ELECTRIC APPLICATION USING VINYL BENZYL ETHER COMPOUND SHOWA HIGHPOLYMER CO LTD 1991-04-17 JP disclosed
JP-H00392343-A 0001-01-01 JP disclosed