SCHEMBL2923052

SCHEMBL2923052

C=CCC(Cl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 3/20 0.44
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2A P28223 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HRH1 P35367 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33
GRM7 Q14831 1/20 0.33
OPRD1 P41143 1/20 0.33

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
Ammonia Solution, Strong SCHEMBL28836131 0.98 CYP2C19 (0.50) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
Chlorobenzene SCHEMBL10336299 0.92 ATM (0.47) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL691762 0.78 CYP2C19 (0.57) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL7056249 0.77 CYP2C19 (0.52) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL6929616 0.77 TSHR (0.44) CYP2C19TSHRALDH1A1KDM4EMAPT
SCHEMBL2371653 0.77 TSHR (0.44) CYP2C19TSHRHTR2ATAAR1HRH1
SCHEMBL3996056 0.76 CYP2C19 (0.55) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL7674344 0.76 CYP2C19 (0.55) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL11201030 0.76 CYP2C19 (0.55) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL9003499 0.76 CYP2C19 (0.55) CYP2C19SMN1; SMN2TSHRALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110054552-A The preparation method and application of the substitution alkyl phenyl acetone of 1,3- bis- 玉林师范学院 2019-07-26 CN claimed
CN-103768991-B Cloudy non-sulfosalt surfactant and preparation method thereof SINOPEC CORP. (CN) 2015-09-09 CN claimed
CN-102974268-B alkyl benzyl polyoxyethylene ether betaine surfactant and preparation method and application thereof CHINESE ACAD TECH INST PHYSICS 2014-06-25 CN claimed
CN-103768991-A Anion/nonionic sulphonate surfactant and preparation method thereof CHINA PETROLEUM & CHEMICAL 2014-05-07 CN claimed
CN-102134283-B Preparation method of associated modified xanthan gum UNIV CHENGDU TECHNOLOGY 2013-04-24 CN claimed
CN-102974268-A Alkyl benzyl polyoxyethylene ether betaine surfactant and preparation method and application thereof CHINESE ACAD TECH INST PHYSICS 2013-03-20 CN claimed
CN-101684405-B Preparation method of gemini long-chain alkyl benzene sulfonate oil-displacing agent PETROCHINA CO LTD 2013-02-13 CN claimed
CN-102344345-A Preparation method of arylene ether compound UNIV NANJING NORMAL 2012-02-08 CN claimed
CN-101850218-A Preparation method of QAS polymer anion exchange membrane UNIV XIAMEN 2010-10-06 CN claimed
CN-101684405-A Preparation method of gemini long-chain alkyl benzene sulfonate oil-displacing agent PETROCHINA CO LTD 2010-03-31 CN claimed
US-6410666-B1 CONTACTING A CYCLOALKENE WITH CHAIN TRANSFER AGENT IN PRESENCE OF METATHESIS CATALYST FORMING TELECHELIC POLYMER; REACTING WITH ALKENE CALIFORNIA INSTITUTE OF TECHNOLOGY 2002-06-25 US claimed
EP-1169364-A1 NOVEL ABA TRIBLOCK AND DIBLOCK COPOLYMERS AND METHODS OF PREPARING THE SAME CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2002-01-09 EP claimed
WO-2000055218-A1 NOVEL ABA TRIBLOCK AND DIBLOCK COPOLYMERS AND METHODS OF PREPARING THE SAME CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-09-21 WO claimed
US-4877687-A SURFACE TREATMENT WITH A QUATERNIZED ACRYLATED RESIN MITSUBISHI RAYON COMPANY, LTD. (JP) 1989-10-31 US claimed
EP-0127672-A1 PROCESS FOR PREPARATION OF ARYLTERPENOID INSECT MATURATION INHIBITORS SCM CORPORATION (US) 1984-12-12 EP claimed
US-4484007-A Process for preparation of arylterpenoid insect maturation inhibitors SCM CORPORATION (US) 1984-11-20 US claimed
WO-1984002337-A1 PROCESS FOR PREPARATION OF ARYLTERPENOID INSECT MATURATION INHIBITORS SCM CORP (US) 1984-06-21 WO claimed
US-4423198-A WITH POLYMERIZABLE TERTIARY AMINE AND CROSSLINKER COPOLYMER RUBBER & CHEMICAL CORPORATION (US) 1983-12-27 US claimed
US-4238373-A QUATERNIZATION THE PROCTER & GAMBLE COMPANY (US) 1980-12-09 US claimed
US-3994984-A Process for removal of chloromethyl ether impurities from alkylbenzyl chlorides MONSANTO COMPANY (US) 1976-11-30 US claimed