SCHEMBL6015498

SCHEMBL6015498

CC(C)(C)CC(C)(C)c1cc(O)c(O)c(C(C)(C)CC(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.51
ALDH1A1 P00352 3/20 0.51
ALOX15 P16050 3/20 0.51
HIF1A Q16665 2/20 0.51
HSD17B10 Q99714 2/20 0.51
CYP2C9 P11712 1/20 0.51
SHBG P04278 1/20 0.47
IDH1 O75874 1/20 0.41
CYP2D6 P10635 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.37
MAPT P10636 2/20 0.37
ESR1 P03372 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
PGR P06401 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
AR P10275 1/20 0.37
DRD1 P21728 1/20 0.37
PTGS1 P23219 1/20 0.37

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
SCHEMBL767213 0.90 SHBG (0.52) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL2290238 0.85 SHBG (0.47) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL8990196 0.85 SHBG (0.47) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL11806573 0.85 CA2 (0.48) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL11800941 0.83 SHBG (0.46) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL7942444 0.82 CYP3A4 (0.53) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL28463799 0.81 SHBG (0.44) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL3460326 0.81 SELL (0.48) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL11803167 0.80 SHBG (0.43) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10
SCHEMBL3820564 0.80 SHBG (0.43) CYP3A4ALDH1A1ALOX15HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1080163-A1 COMPOSITION AND METHOD FOR RADICAL POLYMERISATION OF ETHYLENICALLY UNSATURATED MONOMERS RHODIA CHIMIE (FR) 2001-03-07 EP claimed
WO-1999055797-A1 COMPOSITION AND METHOD FOR RADICAL POLYMERISATION OF ETHYLENICALLY UNSATURATED MONOMERS RHODIA CHIMIE (FR) 1999-11-04 WO claimed
US-9882137-B2 Organic semiconductor composition, organic thin film transistor, electronic paper, and display device FUJIFILM CORPORATION (JP) 2018-01-30 US disclosed
US-9882137-B2 Organic semiconductor composition, organic thin film transistor, electronic paper, and display device FUJIFILM CORPORATION (JP) 2018-01-30 US disclosed
US-20170179387-A1 ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC THIN FILM TRANSISTOR, ELECTRONIC PAPER, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-20170179387-A1 ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC THIN FILM TRANSISTOR, ELECTRONIC PAPER, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
WO-2006074401-A1 ALKYLATION OF HYDROXYARENES WITH OLEFINS, ALCOHOLS AND ETHERS IN IONIC LIQUIDS SI GROUP, INC. (US) 2006-07-13 WO disclosed
EP-1021391-B1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE SA (FR) 2003-12-10 EP disclosed
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
EP-1021391-A1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE (FR) 2000-07-26 EP disclosed
US-6049015-A Method for C-alkylating hydroxylated aromatic compounds RHODIA CHIMIE (FR) 2000-04-11 US disclosed
US-5902516-A STABILIZER FOR THERMOPLASTIC POLYOLEFIN OR ENGINEERING RESINS SUMITOMO CHEMICAL CO., LTD (JP) 1999-05-11 US disclosed
WO-1997016402-A1 METHOD FOR C-ALKYLATING HYDROXYLATED AROMATIC COMPOUNDS RHODIA CHIMIE (FR) 1997-05-09 WO disclosed