Guaiacol

Guaiacol

SCHEMBL9447670

C=C(CC)C(=O)O.COc1ccccc1O.OCC(O)CO

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
TP53 P04637 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
LMNA P02545 3/20 0.44
CYP1A2 P05177 2/20 0.44
AGTR1 P30556 1/20 0.44
TRPV1 Q8NER1 1/20 0.38
CYP3A4 P08684 2/20 0.38
POLB P06746 3/20 0.37
KDM4E B2RXH2 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 2/20 0.36
HTT P42858 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
BCHE P06276 1/20 0.36

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
Guaiacol SCHEMBL6712813 0.83 TP53 (0.69) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL10429895 0.81 TSHR (0.67) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL10489296 0.81 TSHR (0.50) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL4245702 0.79 TSHR (0.58) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL4089861 0.76 CA1 (0.69) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL20522664 0.75 CA1 (0.67) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL339019 0.75 TSHR (0.56) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL27509885 0.74 CA1 (0.86) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL339020 0.74 CYP1A2 (0.63) TSHRTP53CA1CA2LMNA
Guaiacol SCHEMBL27262483 0.73 TP53 (0.69) TSHRTP53CA1CA2LMNA

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-5254429-A Diazo resin, unsaturated self-crosslinkable cellulose ester polymer, dye ANOCOIL (US) 1993-10-19 US disclosed