Phenol

Phenol

SCHEMBL6131175

C=O.CNc1ccccc1.Oc1ccccc1

nearest known ligand 0.64

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.64
CYP3A4 P08684 3/20 0.54
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 2/20 0.54
TP53 P04637 2/20 0.54
THRB P10828 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54
CASP1 P29466 1/20 0.54
RECQL P46063 1/20 0.54
HIF1A Q16665 1/20 0.54
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
GLA P06280 1/20 0.50
CA3 P07451 1/20 0.50
CA4 P22748 1/20 0.50
CA9 Q16790 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA14 Q9ULX7 1/20 0.50

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
Phenol SCHEMBL28085320 0.93 TSHR (0.74) TSHRCYP3A4ALDH1A1HSD17B10TP53
Formaldehyde SCHEMBL23668742 0.88 TSHR (0.82) TSHRCYP3A4ALDH1A1HSD17B10TP53
Phenol SCHEMBL9773973 0.88 TSHR (0.57) TSHRCYP3A4ALDH1A1HSD17B10TP53
Phenol SCHEMBL6131166 0.87 TSHR (0.48) TSHRCYP3A4ALDH1A1HSD17B10TP53
Phenol SCHEMBL27420273 0.86 ALDH1A1 (0.64) TSHRCYP3A4ALDH1A1HSD17B10TP53
Formaldehyde SCHEMBL16341403 0.85 TSHR (0.78) TSHRCYP3A4ALDH1A1HSD17B10TP53
Phenol SCHEMBL6878935 0.80 TSHR (0.54) TSHRCYP3A4ALDH1A1HSD17B10TP53
P-Cresol SCHEMBL17294764 0.80 TSHR (0.61) TSHRCYP3A4ALDH1A1HSD17B10TP53
Formaldehyde SCHEMBL9774158 0.80 ALDH1A1 (0.57) TSHRCYP3A4ALDH1A1HSD17B10TP53
Methyl Alcohol SCHEMBL11681702 0.80 TSHR (0.88) TSHRCYP3A4ALDH1A1HSD17B10TP53

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
US-20050003202-A1 N-substituted arylamino-phenol-formaldehyde condensates BORDEN CHEMICAL FOUNDRY, LLC 2005-01-06 US disclosed
US-6780511-B2 METHANOL TOLERANCE, SOLVENT SOLUBILITY; SELF-CATALYZING CURING AGENTS FOR EPOXY RESINS BORDEN CHEMICAL, INC. 2004-08-24 US disclosed
US-20040048072-A1 N-substituted arylamino-phenol-formaldehyde condensates BORDEN CHEMICAL, INC. 2004-03-11 US disclosed