SCHEMBL4122236

SCHEMBL4122236

OCC(c1ccccc1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
TRPA1 O75762 3/20 0.41
PARP1 P09874 1/20 0.38
LMNA P02545 1/20 0.37
NR1H2 P55055 3/20 0.36
NR1H3 Q13133 3/20 0.36
GSR P00390 1/20 0.36
HTR2A P28223 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RIPK1 Q13546 2/20 0.35
ACP3 P15309 1/20 0.35

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
SCHEMBL22349242 1.00 ESR1 (0.42) ESR1ESR2TRPA1PARP1LMNA
SCHEMBL11041734 0.87 KMT2A (0.40) TRPA1LMNAKDM4ERIPK1
SCHEMBL21555694 0.83 TRPA1 (0.42) TRPA1LMNANR1H2NR1H3RIPK1
SCHEMBL1832214 0.83 TRPA1 (0.44) ESR1ESR2TRPA1PARP1LMNA
SCHEMBL9570698 0.80 ESR1 (0.46) ESR1ESR2TRPA1
SCHEMBL8792907 0.79 PREP (0.39) ESR1ESR2TRPA1PARP1LMNA
SCHEMBL1833541 0.79 LTA4H (0.38) ESR1ESR2TRPA1
SCHEMBL1833543 0.79 LTA4H (0.38) ESR1ESR2TRPA1
SCHEMBL9570660 0.78 ESR1 (0.44) ESR1ESR2ACP3
SCHEMBL9570823 0.78 ESR1 (0.44) ESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106399398-B Biological preparation method of (R) -3, 5-bis (trifluoromethyl) phenethyl alcohol 上海医药工业研究院 2024-07-09 CN claimed
CN-105017245-B Imidazopyridine compound and preparation method and application thereof 华东师范大学 2017-01-18 CN claimed
CN-104230667-B The preparation of R-3,5-bis trifluoromethyl phenylethyl alcohol WANG JIKUAN (CN) 2016-04-06 CN claimed
CN-103232324-B The preparation method of a kind of (R)-3,5-pairs of (trifluoromethyl) phenylethyl alcohols GUANGXI XINJING SCI. & TECH. CO., LTD. (CN) 2016-03-16 CN claimed
CN-105330517-A Method for synthesizing 3,5-bis(trifluoromethyl) phenethyl alcohol ENANTIOTECH CORP LTD 2016-02-17 CN claimed
CN-104230667-A Preparation method of R-3, 5-bis (trifluoromethyl) phenyl ethanol WANG JIKUAN 2014-12-24 CN claimed
CN-101698633-A Method for preparing trifluoromethyl benzyl alcohol by Grignard reaction UNIV JIANGSU POLYTECHNIC 2010-04-28 CN claimed
US-20250270385-A1 DYNAMICALLY CROSSLINKED MULTIBLOCK COPOLYMERS FOR COMPATIBILIZING IMMISCIBLE MIXED PLASTICS COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2025-08-28 US disclosed
WO-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed
CN-106399398-B Biological preparation method of (R) -3, 5-bis (trifluoromethyl) phenethyl alcohol 上海医药工业研究院 2024-07-09 CN disclosed
US-20220033634-A1 CURABLE FLUORINE-BASED ELASTOMER COMPOSITE AND CURED PRODUCT THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2022-02-03 US disclosed
EP-3856830-A1 CURABLE FLUORINE-BASED ELASTOMER COMPOSITE AND CURED PRODUCT THEREOF 3M Innovative Properties Company (US) 2021-08-04 EP disclosed
WO-2020065467-A1 CURABLE FLUORINE-BASED ELASTOMER COMPOSITE AND CURED PRODUCT THEREOF 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-04-02 WO disclosed
EP-0233834-B1 INSECTICIDAL TRIFLUORMETHYL ALKANE DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 1992-04-22 EP disclosed
EP-0415833-A2 Optically active fluorine-containing alcohol compounds and liquid crystal compounds therefrom Showa Shell Sekiyu Kabushiki Kaisha (JP) 1991-03-06 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
US-4791123-A MITICIDES SCHERING AKT. (DE) 1988-12-13 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed
EP-0233834-A1 Insecticidal trifluormethyl alkane derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1987-08-26 EP disclosed
CN-87100438-A insecticidal trifluoromethyl alkane derivatives 1987-08-12 CN disclosed