SCHEMBL829239

SCHEMBL829239

CC(C)CCCCCCCCCCCCCCCOC(=O)c1cc(C(=O)OCCCCCCCCCCCCCCCC(C)C)c(C(=O)OCCCCCCCCCCCCCCCC(C)C)cc1C(=O)OCCCCCCCCCCCCCCCC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.49
ALDH1A1 P00352 4/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RARB P10826 1/20 0.42
ESR1 P03372 1/20 0.41
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41

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
SCHEMBL828932 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695631 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695632 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695613 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695601 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL829111 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL9799237 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695621 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL20695600 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL2579956 1.00 TSHR (0.49) TSHRALDH1A1LMNATP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2548940-B1 LUBRICATING OIL COMPOSITION FOR HIGH-TEMPERATURE APPLICATIONS IDEMITSU KOSAN CO (JP) 2019-11-06 EP claimed
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 EP claimed
US-7595420-B2 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-09-29 US claimed
US-20060247461-A1 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. 2006-11-02 US claimed
EP-4212305-B1 VINYL CHLORIDE RESIN COMPOSITION FOR POWDER MOLDING, VINYL CHLORIDE RESIN MOLDED PRODUCT, AND LAMINATE ZEON CORP (JP) 2025-09-10 EP disclosed
US-12286526-B2 Vinyl chloride resin composition for powder molding, vinyl chloride resin molded product, and laminate ZEON CORPORATION (JP) 2025-04-29 US disclosed
US-20230265276-A1 VINYL CHLORIDE RESIN COMPOSITION FOR POWDER MOLDING, VINYL CHLORIDE RESIN MOLDED PRODUCT, AND LAMINATE ZEON CORPORATION (JP) 2023-08-24 US disclosed
EP-3604427-B1 VINYL CHLORIDE RESIN COMPOSITION, VINYL CHLORIDE RESIN MOLDED PRODUCT, AND LAMINATE ZEON CORP (JP) 2023-08-02 EP disclosed
EP-4212305-A1 VINYL CHLORIDE RESIN COMPOSITION FOR POWDER MOLDING, VINYL CHLORIDE RESIN MOLDED BODY, AND LAYERED PRODUCT Zeon Corporation (JP) 2023-07-19 EP disclosed
CN-116056856-A Vinyl chloride resin composition for powder molding, vinyl chloride resin molded body, and laminate 日本瑞翁株式会社 2023-05-02 CN disclosed
EP-3521362-B1 VINYL CHLORIDE RESIN COMPOSITION, VINYL CHLORIDE RESIN MOLDED PRODUCT, AND LAMINATE ZEON CORP (JP) 2023-02-22 EP disclosed
EP-3438188-B1 VINYL CHLORIDE RESIN COMPOSITION, VINYL CHLORIDE RESIN MOLDED ARTICLE, AND LAMINATE ZEON CORP (JP) 2022-05-11 EP disclosed
EP-1412082-A1 METHOD FOR HYDROGENATING ORGANIC COMPOUNDS BY MEANS OF RU/SIO2 CATALYSTS BASF Aktiengesellschaft (DE) 2004-04-28 EP disclosed
EP-1314714-A2 Method for hydrogenating benzene polycarboxylic acids or derivatives thereof by using a catalyst containing macropores BASF AKTIENGESELLSCHAFT (DE) 2003-05-28 EP disclosed
EP-1042273-B1 METHOD FOR HYDROGENATING BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF BY USING A CATALYST CONTAINING MACROPORES BASF AG (DE) 2003-05-07 EP disclosed
WO-2002100536-A1 METHOD FOR HYDROGENATING ORGANIC COMPOUNDS BY MEANS OF RU/SIO2 CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 2002-12-19 WO disclosed
US-20020019559-A1 Hydrogenation of benzenepolycarboxylic acids or derivatives thereof using a catalyst containing macropores BRUNNER MELANIE (DE) 2002-02-14 US disclosed
US-6284917-B1 Method for hydrogenating benzene polycarboxylic acids or derivatives thereof by using a catalyst containing macropores BASF AKTIENGESELLSCHAFT (DE) 2001-09-04 US disclosed
EP-1042273-A1 METHOD FOR HYDROGENATING BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF BY USING A CATALYST CONTAINING MACROPORES BASF AKTIENGESELLSCHAFT (DE) 2000-10-11 EP disclosed
WO-1999032427-A1 METHOD FOR HYDROGENATING BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF BY USING A CATALYST CONTAINING MACROPORES BASF AKTIENGESELLSCHAFT (DE) 1999-07-01 WO disclosed