SCHEMBL7260925

SCHEMBL7260925

Cc1ccc2ccccc2c1CCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.51
ALDH1A1 P00352 5/20 0.51
HTT P42858 1/20 0.51
CYP1A2 P05177 3/20 0.50
CYP2A6 P11509 3/20 0.50
KDM4E B2RXH2 4/20 0.47
MAPT P10636 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
HSD17B10 Q99714 3/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSP90AA1 P07900 1/20 0.44
HNF4A P41235 1/20 0.44
GAA P10253 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.41
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
SLC2A1 P11166 1/20 0.39

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
SCHEMBL6249203 0.88 TSHR (0.58) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL2608796 0.84 CYP1A2 (0.54) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL2127430 0.82 CYP1A2 (0.52) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL7955051 0.82 TSHR (0.52) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL2846325 0.81 NCEH1 (0.52) TSHRALDH1A1HTTCYP1A2CYP2A6
SCHEMBL7260921 0.81 TSHR (0.50) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL1706721 0.81 TSHR (0.50) TSHRALDH1A1CYP1A2CYP2A6KDM4E
SCHEMBL16042478 0.79 TSHR (0.58) TSHRALDH1A1CYP1A2CYP2A6KDM4E
Ammonia Solution, Strong SCHEMBL28807529 0.79 NCEH1 (0.51) TSHRALDH1A1HTTCYP1A2CYP2A6
SCHEMBL7653479 0.79 TSHR (0.48) TSHRALDH1A1CYP1A2CYP2A6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263714-B2 Epoxy resin composition, cured article thereof, semiconductor sealing material, novel phenol resin, novel epoxy resin, method for producing novel phenol resin, and method for producing novel epoxy resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2012-09-11 US disclosed
US-20110275739-A1 EPOXY RESIN COMPOSITION, CURED ARTICLE THEREOF, SEMICONDUCTOR SEALING MATERIAL, NOVEL PHENOL RESIN, NOVEL EPOXY RESIN, METHOD FOR PRODUCING NOVEL PHENOL RESIN, AND METHOD FOR PRODUCING NOVEL EPOXY RESIN DAINIPPON INK AND CHEMICALS, INC. (JP) 2011-11-10 US disclosed
WO-2003055856-A2 BICYCLIC LACTAM DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-α CONVERTING ENZYME (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-10 WO disclosed
EP-1263755-A2 CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA Bristol-Myers Squibb Pharma Company (US) 2002-12-11 EP disclosed
WO-2001070673-A2 CYCLIC β-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-$g(a) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-27 WO disclosed
US-5817822-A ANTITUOR, ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS NOVARTIS CORPORATION (US) 1998-10-06 US disclosed