Phenol

Phenol

SCHEMBL8668774

CC=C(C)C=C[Ti+3].Cc1ccc(C=CC=Cc2ccc(C)cc2)cc1.[O-]c1ccccc1.[O-]c1ccccc1.[O-]c1ccccc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 2/20 0.40
HPGD P15428 1/20 0.40
TRPM8 Q7Z2W7 2/20 0.38
CYP1B1 Q16678 1/20 0.37
CA1 P00915 1/20 0.36
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.35
MAOB P27338 2/20 0.35
FOS P01100 1/20 0.35
JUN P05412 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
EGFR P00533 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MEN1 O00255 2/20 0.34

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
SCHEMBL8669763 0.84 MAPT (0.38) MAPTALDH1A1CYP3A4HPGDTRPM8
SCHEMBL8665318 0.84 MAOB (0.48) MAPTALDH1A1CYP3A4POLBLMNA
Phenol SCHEMBL8667726 0.81 MAOB (0.38) MAPTALDH1A1CYP3A4HPGDTRPM8
Phenol SCHEMBL8664996 0.81 MAPT (0.37) MAPTALDH1A1CYP3A4HPGDTRPM8
SCHEMBL8669737 0.79 MAOB (0.47) MAPTALDH1A1CYP3A4POLBLMNA
Phenol SCHEMBL8667074 0.75 MAPT (0.30) MAPT
SCHEMBL31659079 0.71 MAOB (0.58) MAPTALDH1A1CYP3A4POLBLMNA
Phenol SCHEMBL8666387 0.71 MAOB (0.34) MAPTALDH1A1CYP3A4HPGDTRPM8
SCHEMBL23458020 0.71 MAOB (0.70) MAPTALDH1A1CYP3A4HPGDTRPM8
SCHEMBL23458019 0.71 MAOB (0.70) MAPTALDH1A1CYP3A4HPGDTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767804-B1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS DOW CHEMICAL CO (US) 1998-12-09 EP disclosed
US-5646084-A OLEFIN POLYMERIZATION USING TITANIUM COMPLEX CATALYST AND ACTIVATING COCATALYST THE DOW CHEMICAL COMPANY (US) 1997-07-08 US disclosed
EP-0767804-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1997-04-16 EP disclosed
US-5543480-A USING GROUP 4 METAL COMPLEXES CONTAINING A DIENE MOIETY THE DOW CHEMICAL COMPANY (US) 1996-08-06 US disclosed
WO-1996000742-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1996-01-11 WO disclosed