SCHEMBL7921184

SCHEMBL7921184

C=Cc1cccc(C)c1C=C.C=Cc1ccccc1C=C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
TSHR P16473 3/20 0.41
CYP1A2 P05177 3/20 0.39
CYP2A6 P11509 2/20 0.39
ACHE P22303 1/20 0.38
KIF11 P52732 1/20 0.35
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHAT P28329 1/20 0.34
ESR2 Q92731 1/20 0.33
KDM4E B2RXH2 3/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
MPI P34949 1/20 0.33
RECQL P46063 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AHR P35869 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL30332485 0.96 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2CYP2A6ACHE
SCHEMBL41438 0.96 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2CYP2A6ACHE
SCHEMBL6469766 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2CYP2A6ACHE
Ethane SCHEMBL29184984 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2CYP2A6ACHE
SCHEMBL28553928 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2CYP2A6ACHE
Benzene SCHEMBL28149237 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2CYP2A6ACHE
Butadiene SCHEMBL10623583 0.91 ALDH1A1 (0.37) ALDH1A1TSHRCYP1A2CYP2A6ACHE
Benzene SCHEMBL8823368 0.89 ALDH1A1 (0.35) ALDH1A1TSHRCYP1A2CYP2A6ACHE
Styrene SCHEMBL10790034 0.88 ALDH1A1 (0.52) ALDH1A1TSHRACHETP53TDP1
Styrene SCHEMBL28143706 0.88 ALDH1A1 (0.52) ALDH1A1TSHRACHETP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3230582-B2 2001-11-19 JP claimed
EP-0673393-B1 THIN-UNTIL-WET ABSORBENT FOAM MATERIALS FOR AQUEOUS BODY FLUIDS AND PROCESS FOR MAKING SAME PROCTER & GAMBLE (US) 1999-01-27 EP claimed
US-5652194-A EMULSION COPOLYMERIZATION OF GLASSY AND RUBBER MONOMERS AND CROSSLINKING AGENT; DEWATERING TO COLLAPSE; EXPANDABLE THE PROCTER & GAMBLE COMPANY (US) 1997-07-29 US claimed
EP-0673393-A1 THIN-UNTIL-WET ABSORBENT FOAM MATERIALS FOR AQUEOUS BODY FLUIDS AND PROCESS FOR MAKING SAME THE PROCTER & GAMBLE COMPANY (US) 1995-09-27 EP claimed
WO-1994013704-A1 THIN-UNTIL-WET ABSORBENT FOAM MATERIALS FOR AQUEOUS BODY FLUIDS AND PROCESS FOR MAKING SAME THE PROCTER & GAMBLE COMPANY (US) 1994-06-23 WO claimed
US-5176832-A Chromatographic separation of sugars using porous gel resins THE DOW CHEMICAL COMPANY (US) 1993-01-05 US claimed
EP-0496405-A1 Porous resin and process for its production MITSUBISHI KASEI CORPORATION (JP) 1992-07-29 EP claimed
EP-0802928-A1 USE OF POLYGLYCEROL ALIPHATIC ETHER EMULSIFIERS IN MAKING HIGH INTERNAL PHASE EMULSIONS THAT CAN BE POLYMERIZED TO PROVIDE ABSORBENT FOAMS THE PROCTER & GAMBLE COMPANY (US) 1997-10-29 EP disclosed
EP-0582062-B1 Novel cross-linked water-absorbent resin HOECHST CELANESE CORP (US) 1997-09-10 EP disclosed
WO-1996021679-A1 USE OF POLYGLYCEROL ALIPHATIC ETHER EMULSIFIERS IN MAKING HIGH INTERNAL PHASE EMULSIONS THAT CAN BE POLYMERIZED TO PROVIDE ABSORBENT FOAMS THE PROCTER & GAMBLE COMPANY (US) 1996-07-18 WO disclosed
US-5478894-A Polymerizing unsaturated water soluble monomer having hydrophilic carboxy group in presence of unsaturated hydrin monomer, contacting product with base to epoxidize, heating to crosslink HOECHST CELANESE CORPORATION (US) 1995-12-26 US disclosed
EP-0582062-A1 Novel cross-linked water-absorbent resin HOECHST CELANESE CORPORATION (US) 1994-02-09 EP disclosed