Phenol

Phenol

SCHEMBL8514977

[O-]c1ccccc1.c1ccc([Al+]c2ccccc2)cc1

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP3A4 P08684 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
ALOX12 P18054 1/20 0.30
PTGS1 P23219 1/20 0.30
SLC6A2 P23975 1/20 0.30
MAPK1 P28482 1/20 0.30
PTGS2 P35354 1/20 0.30
HTR2B P41595 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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 SCHEMBL8511587 0.83 ACHE (0.43) ALDH1A1TDP1CYP3A4CA1CA2
SCHEMBL8511868 0.81 TSHR (0.37) ALDH1A1HSD17B10TDP1CYP3A4CA1
SCHEMBL1228647 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4CA1
Iodide SCHEMBL2166396 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4CA1
Fluoride Ion SCHEMBL1538989 0.81 ALDH1A1 (0.47) ALDH1A1HSD17B10TDP1CYP3A4CA1
Bromide SCHEMBL1538842 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4CA1
Hydrochloric Acid SCHEMBL150126 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4CA1
SCHEMBL148446 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4CA1
Phenol SCHEMBL4184679 0.80 TDP1 (0.44) ALDH1A1HSD17B10TDP1CYP3A4CA1
Water SCHEMBL11465852 0.78 ALDH1A1 (0.37) ALDH1A1HSD17B10TDP1CYP3A4CA1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4025707-A Mixed hydrocarbyloxide treated catalyst activated at different temperatures PHILLIPS PETROLEUM COMPANY (US) 1977-05-24 US claimed
US-3959178-A Mixed hydrocarbyloxide treated catalyst activated at different temperatures PHILLIPS PETROLEUM COMPANY (US) 1976-05-25 US claimed
EP-2643366-B1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORP (US) 2015-03-25 EP disclosed
US-8895465-B2 Activator compositions, their preparation, and their use in catalysis ALBEMARLE CORPORATION (US) 2014-11-25 US disclosed
EP-2643366-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS Albemarle Corporation (US) 2013-10-02 EP disclosed
US-20130253155-A1 Activator Compositions, Their Preparation, and Their Use In Catalysis ALBEMARIE CORPORATION (US) 2013-09-26 US disclosed
WO-2012071205-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORPORATION (US) 2012-05-31 WO disclosed
US-4025707-A Mixed hydrocarbyloxide treated catalyst activated at different temperatures PHILLIPS PETROLEUM COMPANY (US) 1977-05-24 US disclosed
US-3959178-A Mixed hydrocarbyloxide treated catalyst activated at different temperatures PHILLIPS PETROLEUM COMPANY (US) 1976-05-25 US disclosed
US-3947433-A ORGANOBORON COMPOUND, HYDROCARBYL ALUMINUM HYDROCARBYL OXIDE PHILLIPS PETROLEUM COMPANY (US) 1976-03-30 US disclosed