SCHEMBL1955686

SCHEMBL1955686

CC(C)(Cc1ccc(O)cc1)c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.81
ESR2 Q92731 7/20 0.81
ALDH1A1 P00352 1/20 0.55
CYP3A4 P08684 1/20 0.55
BLM P54132 1/20 0.50
SHBG P04278 1/20 0.48
TAAR1 Q96RJ0 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KIF11 P52732 1/20 0.45
OPRK1 P41145 1/20 0.45
ME2 P23368 1/20 0.43
ME1 P48163 1/20 0.43
ME3 Q16798 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
Phenol SCHEMBL28177013 0.92 ESR1 (0.68) ESR1ESR2ALDH1A1CYP3A4SHBG
SCHEMBL2803160 0.90 ESR1 (1.00) ESR1ESR2ALDH1A1CYP3A4BLM
SCHEMBL115909 0.85 TAAR1 (0.56) ESR1ESR2CYP3A4TAAR1CYP1A2
SCHEMBL27833316 0.85 ESR1 (0.69) ESR1ESR2ALDH1A1CYP3A4SHBG
SCHEMBL28813909 0.84 ESR1 (0.88) ESR1ESR2CYP3A4BLMSHBG
SCHEMBL1954830 0.82 ESR1 (0.85) ESR1ESR2ALDH1A1CYP3A4BLM
SCHEMBL2416999 0.82 ESR1 (0.60) ESR1ESR2ALDH1A1CYP3A4BLM
SCHEMBL1954760 0.82 ESR1 (0.85) ESR1ESR2ALDH1A1CYP3A4BLM
SCHEMBL8866151 0.81 BLM (0.56) ESR1ESR2ALDH1A1CYP3A4BLM
SCHEMBL27936060 0.81 ESR1 (0.81) ESR1ESR2ALDH1A1CYP3A4BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102977301-B A kind of preparation method of rosin modified phenolic ink resin 上海华谊(集团)公司 2017-03-29 CN claimed
CN-105126910-A C2-symmetric imidazolephenyl rare earth metal catalyst, preparation method and application BEIJING INST TECHNOLOGY 2015-12-09 CN claimed
EP-3838892-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2022-10-12 EP disclosed
EP-3293173-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2021-07-28 EP disclosed
EP-3838892-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Kabushiki Kaisha (JP) 2021-06-23 EP disclosed
EP-2980066-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2021-04-21 EP disclosed
CN-110536797-A Multilayer film, the intermediate coat comprising the multilayer film and the laminated glass comprising the intermediate coat and sound control glass laminate CHANG CHUN PETROCHEMICAL CO LTD 2019-12-03 CN disclosed
CN-107266338-B The manufacturing method of isocyanates 旭化成株式会社 2019-10-11 CN disclosed
EP-3153499-B1 METHOD FOR PRODUCING N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2018-09-19 EP disclosed
EP-3293173-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Kabushiki Kaisha (JP) 2018-03-14 EP disclosed
CN-105102422-B Method for producing isocyanate 旭化成株式会社 2018-01-09 CN disclosed
CN-101629331-B Method for drawing ultra-high molecular weight polyethylene fiber NINGBO RONGYI CHEM FIBER SCI 2011-01-26 CN disclosed
CN-101069244-B Cycloalkane-based oil, cycloalkane-based dielectric liquid prepared from cycloalkane-based oil, and process for producing the same Shell int research co ltd 2010-05-05 CN disclosed
CN-101684573-A Method for preparing ultra-high molecular weight polyethylene fibers NINGBO RONGYI CHEM FIBER SCI 2010-03-31 CN disclosed
CN-101629330-A Method for drawing ultra-high molecular weight polyethylene fiber NINGBO RONGYI CHEM FIBER SCI 2010-01-20 CN disclosed
CN-101629331-A Method for drawing ultra-high molecular weight polyethylene fiber NINGBO RONGYI CHEM FIBER SCI 2010-01-20 CN disclosed
CN-101629326-A Method for post-treating ultra-high molecular weight polyethylene fiber NINGBO RONGYI CHEM FIBER SCI 2010-01-20 CN disclosed
CN-101575756-A Stretching method of ultra-high molecular weight polyethylene precursor fiber NINGBO RONGYI CHEM FIBER SCI (CN) 2009-11-11 CN disclosed
CN-101069244-A Cycloalkane-based oil, cycloalkane-based dielectric liquid prepared from cycloalkane-based oil, and process for producing the same SHELL INT RESEARCH (NL) 2007-11-07 CN disclosed
CN-1221441-A Flame retardant thermo plastic resin composition KANEKA CORP (JP) 1999-06-30 CN disclosed