SCHEMBL11005388

SCHEMBL11005388

CCCCCCCCCCc1ccccc1COCc1ccccc1CCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.56
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
ALOX5 P09917 2/20 0.46
PTGS2 P35354 2/20 0.46
TP53 P04637 2/20 0.46
CYP3A4 P08684 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
TYR P14679 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PPARA Q07869 2/20 0.44
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44

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
SCHEMBL15162085 1.00 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL11127871 1.00 LIPG (0.56) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL2141528 0.98 LIPG (0.53) LIPGTHRATHRBNR1H2NR1H3
Ether SCHEMBL11033883 0.94 LIPG (0.51) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL15162504 0.92 LIPG (0.46) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL9579123 0.90 F7 (0.51) LIPGTHRATHRBMAPTALOX15
SCHEMBL18496530 0.87 LIPG (0.69) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL15809821 0.87 LIPG (0.69) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL10755599 0.87 LIPG (0.69) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL6679764 0.87 LIPG (0.69) LIPGTHRATHRBNR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4506061-A COORDINATION CATALYST, RANDOM JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1985-03-19 US disclosed
US-4377671-A Process for producing olefinic copolymer rubbers JAPAN EP RUBBER CO., LTD. (JP) 1983-03-22 US disclosed
US-4356160-A CARRIED OUT IN AN ORGANIC SOLVENT AND AN ETHER WITH AN METAL CATALYSTS JAPAN EP RUBBER CO., LTD. (JP) 1982-10-26 US disclosed
US-4271035-A CONTAINING A POLYALKYLENE GLYCOL DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1981-06-02 US disclosed
US-4200717-A Preparation of propylene polymer-containing solid titanium trichloride and propylene polymers using same MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1980-04-29 US disclosed
US-4115532-A LEWIS ACIDS, HEATING, PRECIPITATION MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1978-09-19 US disclosed
US-4115533-A REDUCING TITANIUM TETRACHLORIDE WITH AN ORGANIC ALUMINUM COMPOUND MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1978-09-19 US disclosed
US-4060593-A Preparation of titanium trichloride MITSUBISHI CHEMICAL INDUSTRIES (JA) 1977-11-29 US disclosed