SCHEMBL716670

SCHEMBL716670

CC(C)CC(OC(=O)c1ccc(C(=O)O)cc1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.45
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
KMT2A Q03164 2/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
ALDH1A1 P00352 4/20 0.43
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
GRIA4 P48058 1/20 0.41
RARB P10826 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
TAS2R14 Q9NYV8 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39

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
SCHEMBL25982607 0.88 TSHR (0.50) PDCD1CD274KMT2AALDH1A1TP53
SCHEMBL6229457 0.85 MAPT (0.57) MAPTMAPK1PDCD1CD274CA1
SCHEMBL3703669 0.84 FOLH1 (0.43) MAPTCA1CA2KMT2ACA12
SCHEMBL7859275 0.84 MAPT (0.51) MAPTMAPK1PDCD1CD274CA1
SCHEMBL6233408 0.82 MAPT (0.50) MAPTMAPK1PDCD1CD274CA1
SCHEMBL571244 0.81 TSHR (0.53) PDCD1CD274KMT2AALDH1A1TP53
SCHEMBL14928772 0.80 MAPK1 (0.50) MAPTMAPK1CA1CA2KMT2A
SCHEMBL3688191 0.80 MAPT (0.48) MAPTMAPK1ALDH1A1RARBTP53
SCHEMBL246586 0.78 ALDH1A1 (0.52) MAPTCA1CA2KMT2ACA12
SCHEMBL29672356 0.78 MAPT (0.45) MAPTMAPK1PDCD1CD274CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110204439-A A kind of method that the cracking of terylene waste spinning prepares crude terephthalic acid diisobutyl ester 中塑联新材料科技湖北有限公司 2019-09-06 CN claimed
CN-103087305-B A kind of Biodegradable aromatic-aliphatic copolyester and preparation method thereof Shanghai Genius Advanced Material (Group) Co., Ltd. (CN) 2015-11-18 CN claimed
CN-102585180-B Copolyester based on 2, 3-butanediol and preparation method thereof SHANGHAI GENIUS ADVANCED MAT 2015-03-25 CN claimed
CN-103570925-A Biodegradable polyester and preparation method thereof SHANGHAI GENIUS ADVANCED MAT 2014-02-12 CN claimed
CN-103265689-A Copolymer of aliphatic polycarbonate and aromatic polyester and preparation method thereof CHINESE ACAD INST CHEMISTRY 2013-08-28 CN claimed
CN-103159907-A High-molecular-weight polyester plastic based on 2,3-butanediol and preparation method for same SHANGHAI GENIUS ADVANCED MAT 2013-06-19 CN claimed
CN-103087305-A Biodegradable aromatic-aliphatic copolyester and preparation method thereof SHANGHAI GENIUS ADVANCED MAT 2013-05-08 CN claimed
CN-102585180-A Copolyester based on 2,3-butanediol and preparation method thereof SHANGHAI GENIUS ADVANCED MAT 2012-07-18 CN claimed
CN-102485765-A Aliphatic/aromatic copolyester and preparation method thereof SHANGHAI GENIUS ADVANCED MAT 2012-06-06 CN claimed
CN-1356973-A Selected cyclohexane-1, 3-and-1, 4-dicarboxylic acid esters BASF AG (DE) 2002-07-03 CN claimed
EP-4574810-A1 STATIC MIXERS IN THE PRODUCTION OF ALICYCLIC CARBOXYLIC ACIDS AND THEIR ESTERS Evonik Oxeno GmbH & Co. KG (DE) 2025-06-25 EP disclosed
EP-3392036-B1 METHOD FOR PRODUCING LAMINATE, AND LAMINATE KANEKA CORP (JP) 2022-03-30 EP disclosed
CN-110204439-A A kind of method that the cracking of terylene waste spinning prepares crude terephthalic acid diisobutyl ester 中塑联新材料科技湖北有限公司 2019-09-06 CN disclosed
CN-110204439-A A kind of method that the cracking of terylene waste spinning prepares crude terephthalic acid diisobutyl ester 中塑联新材料科技湖北有限公司 2019-09-06 CN disclosed
CN-110204439-A A kind of method that the cracking of terylene waste spinning prepares crude terephthalic acid diisobutyl ester 中塑联新材料科技湖北有限公司 2019-09-06 CN disclosed
CN-1168748-C Process for producing polyethylene 伊斯曼化学公司 2004-09-29 CN disclosed
CN-1089082-C Process for the preparation of cyclohexanedimethanol SKNJC CO LTD (KR) 2002-08-14 CN disclosed
CN-1356973-A Selected cyclohexane-1, 3-and-1, 4-dicarboxylic acid esters BASF AG (DE) 2002-07-03 CN disclosed
CN-1348472-A Process for producing polyethylene EASTMAN CHEM CO (US) 2002-05-08 CN disclosed
CN-1223631-A Process for the preparation of cyclohexanedimethanol NEW JAPAN CHEM CO LTD (JP) 1999-07-21 CN disclosed