Phenol

Phenol

SCHEMBL11460587

O=C(O)Oc1ccccc1.O=C(O)Oc1ccccc1.Oc1ccccc1

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
GLA P06280 1/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LTA4H P09960 1/20 0.50
NR1H2 P55055 1/20 0.50
BAX Q07812 1/20 0.50
NSD2 O96028 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ELANE P08246 1/20 0.45

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
SCHEMBL37064 0.90 TDP1 (0.54) TDP1ALOX15HPGDHSD17B10NSD2
Resorcinol SCHEMBL27222324 0.89 CYP3A4 (0.60) TDP1CA12CA1CA2CA9
Bicarbonate SCHEMBL27833263 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
SCHEMBL28599729 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
SCHEMBL27812281 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
Hydrochloric Acid SCHEMBL8603620 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
Ammonia Solution, Strong SCHEMBL10392312 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
Ammonia Solution, Strong SCHEMBL28972528 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
Fluoride SCHEMBL27906569 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2
SCHEMBL27415781 0.87 TDP1 (0.52) TDP1ALOX15HPGDHSD17B10NSD2

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
EP-0006842-A1 Organophosphonate co-ester, stabiliser composition containing it and synthetic resin stabilised therewith S.A. Diamond Shamrock Benelux N.V. (BE) 1980-01-23 EP disclosed