SCHEMBL2401337

SCHEMBL2401337

C=C(C(=O)OCCCCC)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.54
TP53 P04637 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAPK1 P28482 1/20 0.54
LMNA P02545 3/20 0.53
ALDH1A1 P00352 3/20 0.53
TDP1 Q9NUW8 2/20 0.51
CNR2 P34972 1/20 0.49
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
PPARG P37231 3/20 0.46

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
SCHEMBL868427 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL11804383 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL7936965 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL17097244 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL2722719 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL4903661 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL4911615 0.98 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL316833 0.95 TSHR (0.53) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL28461506 0.91 TSHR (0.49) TSHRTP53CYP3A4MAPK1LMNA
SCHEMBL4912837 0.90 TDP1 (0.58) TSHRLMNAALDH1A1TDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109608590-A A kind of polycarboxylic admixture and preparation method thereof suitable for high temperature spray-drying 江苏苏博特新材料股份有限公司 2019-04-12 CN claimed
CN-109476918-A Elastomer composition and use thereof 美国陶氏有机硅公司 2019-03-15 CN claimed
CN-107474372-A UL electric wires 150 DEG C of irradiation cross-linking low smoke halogen-free fire retardant polyolefin cable materials and preparation method thereof 中广核高新核材集团有限公司 2017-12-15 CN claimed
CN-102585381-B Material for full-closed infusion polypropylene upright soft bottle and preparation method and application of material Guangzhou honsea chemistry co ltd 2013-10-23 CN claimed
CN-103319387-A Preparation method of thiophenol compound antioxidant product UNIV CHANGZHOU 2013-09-25 CN claimed
CN-103288988-A Preparation method of styrenated bisphenol A derivative for polyvinyl chloride terminating agent UNIV CHANGZHOU 2013-09-11 CN claimed
CN-102276932-B Pull-tab outer cover material used for infusion bottles or bags and preparation method thereof GUANGZHOU HONSEA ENTPR CO LTD 2013-03-13 CN claimed
CN-101665585-B Method for preparing ternary complex antiager and emulsion and application thereof in neoprene JIANGSU POLYTECHNIC UNIVERSITY (CN) 2011-12-28 CN claimed
CN-102276932-A Pull-tab outer cover material used for infusion bottles or bags and preparation method thereof 2011-12-14 CN claimed
CN-101148408-B Method for preparing bisphenolmonoacryates compounds antioxidant UNIV JIANGSU POLYTECHNIC 2011-01-19 CN claimed
CN-101665585-A Method for preparing ternary complex antiager and emulsion and application thereof in neoprene UNIV JIANGSU POLYTECHNIC 2010-03-10 CN claimed
CN-101148408-A Method for preparing bisphenolmonoacryates compounds antioxidant UNIV JIANGSU POLYTECHNIC (CN) 2008-03-26 CN claimed
CN-105319850-B Photosensitive polymer combination 东友精细化工有限公司 2019-10-11 CN disclosed
CN-105646817-B Polycarbonate diol, process for producing the same, and polyurethane and active energy ray-curable polymer composition each comprising the same 三菱化学株式会社 2019-08-13 CN disclosed
CN-109608590-A A kind of polycarboxylic admixture and preparation method thereof suitable for high temperature spray-drying 江苏苏博特新材料股份有限公司 2019-04-12 CN disclosed
CN-109476918-A Elastomer composition and use thereof 美国陶氏有机硅公司 2019-03-15 CN disclosed
US-20060060997-A1 Polarizing plate protective film and manufacturing method for the same KONICA MINOLTA OPTO, INC. 2006-03-23 US disclosed
CN-1568698-A Heat volatile material for preventing and controlling pests SUMITOMO CHEMICAL CO (JP) 2005-01-26 CN disclosed
CN-1413465-A Termal evaporation pesticide tablet SUMITOMO CHEMICAL CO (JP) 2003-04-30 CN disclosed
CN-1319337-A Liquid pesticide for fumigating and method for using same SUMITOMO CHEMICAL CO (JP) 2001-10-31 CN disclosed