SCHEMBL722115

SCHEMBL722115

CC(C)(C)OC(=O)c1ccccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
ALOX15 P16050 2/20 0.56
AKR1C3 P42330 2/20 0.45
HSD17B10 Q99714 4/20 0.44
KDM4E B2RXH2 4/20 0.44
TSHR P16473 3/20 0.44
HPGD P15428 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
HMGB1 P09429 2/20 0.44
NAPRT Q6XQN6 2/20 0.44
ESR1 P03372 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
GGT1 P19440 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
BLM P54132 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL30339401 1.00 ALDH1A1 (0.56) ALDH1A1ALOX15AKR1C3HSD17B10KDM4E
Water SCHEMBL28274877 0.98 ALDH1A1 (0.54) ALDH1A1ALOX15AKR1C3HSD17B10KDM4E
Hydrogen Peroxide SCHEMBL29048859 0.94 TSHR (0.48) ALDH1A1ALOX15HSD17B10TSHRTDP1
Phenol SCHEMBL26628019 0.93 ALDH1A1 (0.49) ALDH1A1ALOX15AKR1C3HSD17B10KDM4E
SCHEMBL30111657 0.92 TSHR (0.50) ALDH1A1HSD17B10TSHRTDP1CA1
SCHEMBL109178 0.92 TSHR (0.50) ALDH1A1HSD17B10TSHRTDP1CA1
SCHEMBL828388 0.86 ALDH1A1 (0.54) ALDH1A1ALOX15AKR1C3HSD17B10KDM4E
Salicylic Acid SCHEMBL7397613 0.85 HPGD (0.62) ALDH1A1ALOX15HSD17B10KDM4ETSHR
SCHEMBL30162701 0.85 ALDH1A1 (0.48) ALDH1A1ALOX15AKR1C3HSD17B10KDM4E
SCHEMBL7996350 0.85 CYP2C19 (0.43) ALDH1A1ALOX15HSD17B10TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354848-B Ginger aroma compound, preparation method thereof and ginger aroma base 波顿香料股份有限公司 2025-06-03 CN claimed
CN-119350856-A Silicon ester-based flexible vulcanizable material and preparation method thereof 芜湖佳宏新材料股份有限公司 2025-01-24 CN claimed
CN-117157350-A Encapsulant composition for optical device and encapsulant film for optical device using same 株式会社LG化学 2023-12-01 CN claimed
CN-116354848-A Ginger aroma compound, preparation method thereof and ginger aroma base 波顿香料股份有限公司 2023-06-30 CN claimed
EP-4107143-A1 EFFICIENT AND SELECTIVE ROUTE FOR THE SYNTHESIS OF ALKYL 2-BENZOYLBENZOATE Dow Global Technologies LLC (US) 2022-12-28 EP claimed
CN-111040705-B Marble glue composition and preparation method thereof 杭州之江新材料有限公司 2021-04-27 CN claimed
CN-107286483-A A kind of instrument potted component rubber 安徽瑞鑫自动化仪表有限公司 2017-10-24 CN claimed
CN-106800685-A A kind of tear-resistant cable of waterproof 晋源电气集团股份有限公司 2017-06-06 CN claimed
CN-106398251-A Integrated novel double-sided PVC trough plate 安徽优丽普科技股份有限公司 2017-02-15 CN claimed
CN-106366661-A New energy-saving environment-friendly PVC (Polyvinyl Chloride) trough plate for shelf display 安徽优丽普科技股份有限公司 2017-02-01 CN claimed
CN-105801944-A Inflaming-retarding tear-resisting fireproof cable material 安徽瑞侃电缆科技有限公司 2016-07-27 CN claimed
CN-105199263-A High performance computer cable sheathing compound ANHUI LAND GROUP CO LTD 2015-12-30 CN claimed
CN-1854173-B Fabric reinforcement using modified cyclic olefin copolymer and resin substrate for printed circuit board SAMSUNG ELECTRO MECH 2010-05-12 CN claimed
CN-100422130-C Method for making carboxylic acids RHODIA POLYAMIDE INTERMEDIATES (FR) 2008-10-01 CN claimed
CN-100404490-C Method for making carboxylic acids RHODIA POLYAMIDE INTERMEDIATES (FR) 2008-07-23 CN claimed
CN-1854173-A Fabric reinforcement using modified cyclic olefin copolymer and resin substrate for printed circuit board SAMSUNG ELECTRIC MECH (KR) 2006-11-01 CN claimed
CN-1714069-A Process for producing carboxylic acid RHODIA POLYAMIDE INTERMEDIATES (FR) 2005-12-28 CN claimed
CN-1714068-A Process for producing carboxylic acid RHODIA POLYAMIDE INTERMEDIATES (FR) 2005-12-28 CN claimed
US-5221795-A PROCESS FOR PRODUCING OLEFIN OXIDES ENIRICERCHE S.P.A. (IT) 1993-06-22 US claimed
CN-1057847-A The lower optical densities polymkeric substance that photoresist material and optical application are used and the preparation method of multipolymer HOECHST CELANESE CORP (US) 1992-01-15 CN claimed