SCHEMBL3355077

SCHEMBL3355077

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.45
HSD17B10 Q99714 1/20 0.45
ESR1 P03372 7/20 0.43
ESR2 Q92731 5/20 0.43
CYP3A4 P08684 2/20 0.43
ALDH1A1 P00352 1/20 0.43
BLM P54132 1/20 0.43
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
PGR P06401 1/20 0.39
CHRM2 P08172 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39
CYP2D6 P10635 1/20 0.39
CHRM1 P11229 1/20 0.39
ALOX15 P16050 1/20 0.39
DRD1 P21728 1/20 0.39
TBXA2R P21731 1/20 0.39
PTGS1 P23219 1/20 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
SCHEMBL26621253 1.00 CYP2C9 (0.45) CYP2C9HSD17B10ESR1ESR2CYP3A4
SCHEMBL25152152 0.85 MAPT (0.51) MAPTCYP2D6SLC6A2CYP2C19SLC6A3
SCHEMBL3299318 0.85 MAPT (0.51) MAPTCYP2D6SLC6A2CYP2C19SLC6A3
SCHEMBL25152388 0.85 MAPT (0.51) MAPTCYP2D6SLC6A2CYP2C19SLC6A3
SCHEMBL364044 0.84 CYP1A2 (0.42) MAPTLMNACYP1A2CYP2C19FFAR1
SCHEMBL28390790 0.84 CYP2C9 (0.41) CYP2C9HSD17B10ESR1ESR2CYP3A4
SCHEMBL21981255 0.84 BLM (0.42) CYP2C9HSD17B10ESR1ESR2CYP3A4
SCHEMBL9360109 0.81 ESR1 (0.58) ESR1ESR2TDP1CA2CAMK2A
SCHEMBL28215963 0.81 ESR1 (0.44) CYP2C9HSD17B10ESR1ESR2CYP3A4
SCHEMBL29185565 0.80 HIF1A (0.47) CYP2C9HSD17B10BLMMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118185108-A Preparation method of natural collagen-based thermochromic film 陕西科技大学 2024-06-14 CN claimed
CN-115038748-B Composition and method for producing the same 瑞士新集团股份有限公司 2024-04-12 CN claimed
CN-115141540-B Silver ion wall coating and preparation method thereof 周志茹 2024-04-05 CN claimed
CN-112449633-B Method for storing and/or transporting oxo alcohols 沙特基础全球技术有限公司 2023-12-19 CN claimed
CN-110312757-B Ethylene-alpha-olefin copolymer-triallyl phosphate composition 陶氏环球技术有限责任公司 2023-11-28 CN claimed
CN-116874964-A High-adhesiveness heat-conducting phase-change material and preparation method thereof 浙江三元电子科技有限公司 2023-10-13 CN claimed
CN-113997657-B Oil-resistant acid foam, preparation method and application thereof 苏州世诺新材料科技有限公司 2023-06-23 CN claimed
CN-110494485-B Polyethylene blend compositions 陶氏环球技术有限责任公司 2023-03-10 CN claimed
CN-115717059-A Ester composition for liquid-cooled cooling liquid, liquid-cooled cooling liquid and preparation method of liquid-cooled cooling liquid 纯钧新材料(深圳)有限公司 2023-02-28 CN claimed
CN-115558091-A Black hydrophilic polyester and preparation method thereof 中国纺织科学研究院有限公司 2023-01-03 CN claimed
WO-2007039719-A1 THERMOPLASTIC POLYMER ADDITIVE COMPOSITONS COLORMATRIX EUROPE LIMITED (GB) 2007-04-12 WO claimed
EP-1765963-A1 LUBRICATING OIL COMPOSITION Shell Internationale Research Maatschappij B.V. (NL) 2007-03-28 EP claimed
WO-2006005711-A1 LUBRICATING OIL COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2006-01-19 WO claimed
WO-2006005713-A1 LUBRICATING OIL COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2006-01-19 WO claimed
EP-1549704-A1 STABILIZED POLYMER COMPOSITION Borealis Technology Oy (FI) 2005-07-06 EP claimed
CN-1604957-A Lubricating oil having enhanced resistance to oxidation, nitration and viscosity increase CHEVRON ORONITE CO (US) 2005-04-06 CN claimed
WO-2004033545-A1 STABILIZED POLYMER COMPOSITION BOREALIS TECHNOLOGY OY (FI) 2004-04-22 WO claimed
EP-0760831-B1 POLYESTER/POLYCARBONATE BLENDS HAVING ENHANCED PROPERTIES CIBA GEIGY AG (CH) 1997-12-17 EP claimed
EP-0566295-A2 Acrylic modifiers and blends ROHM AND HAAS COMPANY (US) 1993-10-20 EP claimed
EP-0226467-A2 Flame retardant polyolefin material and method TECHLON FIBERS CORPORATION (US) 1987-06-24 EP claimed