Phenol

Phenol

SCHEMBL28085209

COS(=O)(=O)c1cccc([N+](=O)[O-])c1.Oc1ccccc1.S.[Zn]

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
GAA P10253 2/20 0.51
HTT P42858 1/20 0.51
ALDH1A1 P00352 2/20 0.50
F2 P00734 2/20 0.50
PRSS1 P07477 2/20 0.50
PRSS2 P07478 2/20 0.50
PRSS3 P35030 2/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
CA2 P00918 2/20 0.49
CA1 P00915 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
CA5A P35218 1/20 0.49
DDX3X O00571 1/20 0.48
PRMT5 O14744 1/20 0.47

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
SCHEMBL1317032 0.87 KMT2A (0.66) KMT2AGAAHTTALDH1A1F2
SCHEMBL28261651 0.86 KMT2A (0.64) KMT2AGAAHTTALDH1A1F2
Dinitrophenylene SCHEMBL28343244 0.84 KMT2A (0.57) KMT2AGAAHTTALDH1A1F2
Phenol SCHEMBL28105825 0.82 KMT2A (0.58) KMT2AGAAHTTALDH1A1F2
Phenol SCHEMBL27464616 0.80 GAA (0.60) KMT2AGAAHTTALDH1A1F2
Nitrobenzene SCHEMBL28829609 0.80 LMNA (0.57) KMT2AGAAHTTALDH1A1F2
Phenol SCHEMBL28106348 0.80 KMT2A (0.55) KMT2AGAAHTTALDH1A1F2
Phenol SCHEMBL28144847 0.78 ALDH1A1 (0.47) ALDH1A1F2PRSS1PRSS2PRSS3
Phenol SCHEMBL28085239 0.78 TDP1 (0.44) GAATSHRCA2CA1SMN1; SMN2
SCHEMBL14575229 0.77 KMT2A (0.60) KMT2AGAAHTTALDH1A1F2

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-103446725-B Golf 邓禄普体育用品株式会社 2016-08-10 CN disclosed