SCHEMBL962294

SCHEMBL962294

CC(O)Cc1cc(CC(C)O)cc(CC(C)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.40
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 2/20 0.37
ALOX15 P16050 3/20 0.36
ALOX12 P18054 3/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
ESR1 P03372 2/20 0.36
TP53 P04637 2/20 0.36
CYP3A4 P08684 2/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 2/20 0.36
RECQL P46063 2/20 0.36
KMT2A Q03164 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TRPA1 O75762 2/20 0.36
SLC6A2 P23975 2/20 0.36
NR1I2 O75469 1/20 0.36

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
SCHEMBL8985983 0.92 TAAR1 (0.43) TDP1ALOX15ALOX12ALDH1A1KDM4E
SCHEMBL21580259 0.89 ACHE (0.40) TSHRALOX15ALOX12ALDH1A1KDM4E
SCHEMBL5950180 0.87 GABRA1 (0.38) NOS2TDP1ALOX15ALOX12ALDH1A1
SCHEMBL5950554 0.87 TSHR (0.42) NOS2TSHRALOX15ALOX12ALDH1A1
SCHEMBL21825700 0.84 NOS2 (0.48) NOS2TSHRALDH1A1KMT2ATRPA1
SCHEMBL2965194 0.84 PNMT (0.47) TDP1TSHRALOX15ALOX12ALDH1A1
SCHEMBL6157363 0.83 HMGCR (0.46) NOS2TSHRTP53POLBCYP2C19
SCHEMBL21580264 0.83 NOS2 (0.32) NOS2TDP1ALDH1A1TP53
SCHEMBL5950378 0.83 TAAR1 (0.44) ALDH1A1PTGS2CYP19A1GABRA1GABRB2
SCHEMBL11094905 0.83 GABRA1 (0.33) NOS2TRPA1LMNAGABRA1GABRB2

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579058-B1 Butyl rubber with a bimodal molecular weight distribution BAYER RUBBER INC (CA) 1996-05-29 EP claimed
US-RE34640-E Polymerizing isobutylene, adding monomer to make block polymer; metal halide, initiator and electron pair doner solvent UNIVERSITY OF AKRON (US) 1994-06-14 US claimed
EP-0579058-A1 Butyl rubber with a bimodal molecular weight distribution BAYER RUBBER INC. (CA) 1994-01-19 EP claimed
US-5194538-A Hydroxy Initiators POLYSAR CORPORATION (CA) 1993-03-16 US claimed
WO-1991011468-A1 NEW THERMOPLASTIC ELASTOMERS THE UNIVERSITY OF AKRON (US) 1991-08-08 WO claimed
US-4946899-A CARBOCATIONIC POLYMERIZATION INVOLVING HOMOPOLYMERIZATION OF ELASTOMER FOLLOWED BY COPOLYMERIZATION TO ADD GLASSY SEGMENTS; FORMING LIVING POLYMERS WITH A METAL HALIDE, PROMOTER AND SOLVENT MIXTURE THE UNIVERSITY OF AKRON (US) 1990-08-07 US claimed
US-10889146-B2 Tire object provided with an elastomer layer made of a thermoplastic elastomer in the form of an (A-b-(a-methylstyrene-co-B))n-b-C block copolymer COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-01-12 US disclosed
US-10030131-B2 Pneumatic object provided with a gastight layer containing a thermoplastic elastomer and a thermoplastic COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2018-07-24 US disclosed
US-9914328-B2 Inflatable object provided with a gas-tight layer containing a thermoplastic elastomer and a hydrocarbon-based resin COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (CH) 2018-03-13 US disclosed
US-20180043734-A1 TIRE OBJECT PROVIDED WITH AN ELASTOMER LAYER MADE OF A THERMOPLASTIC ELASTOMER IN THE FORM OF AN (A-B-(A-METHYLSTYRENE-CO-B))N-B-C BLOCK COPOLYMER COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2018-02-15 US disclosed
EP-2976218-B1 MULTILAYER LAMINATE FOR TYRES MICHELIN & CIE (FR) 2017-01-25 EP disclosed
US-20160059522-A1 MULTILAYER LAMINATE FOR TIRES COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2016-03-03 US disclosed
EP-2976218-A1 MULTILAYER LAMINATE FOR TYRES Compagnie Générale des Etablissements Michelin (FR) 2016-01-27 EP disclosed
US-6120972-A COPOLYMER OF ACRYLIC ESTER AND CARBONATE WITH PHOTOACID GENERATOR FOR PHOTOSENSITIVE ELEMENTS JSR CORPORATION (JP) 2000-09-19 US disclosed
EP-0930541-A1 Radiation sensitive resin composition JSR Corporation (JP) 1999-07-21 EP disclosed
EP-0901043-A1 Radiation-sensitive resin composition JSR Corporation (JP) 1999-03-10 EP disclosed
EP-0579058-B1 Butyl rubber with a bimodal molecular weight distribution BAYER RUBBER INC (CA) 1996-05-29 EP disclosed
EP-0579058-A1 Butyl rubber with a bimodal molecular weight distribution BAYER RUBBER INC. (CA) 1994-01-19 EP disclosed
US-5242983-A Bone cement EDISON POLYMER INNOVATION CORPORATION 1993-09-07 US disclosed
US-5194538-A Hydroxy Initiators POLYSAR CORPORATION (CA) 1993-03-16 US disclosed