SCHEMBL6740803

SCHEMBL6740803

Cc1c(F)c(F)c(C(=O)Cl)c(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 14/20 0.45
TAS1R1 Q7RTX1 13/20 0.45
TAS1R2 Q8TE23 13/20 0.45
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
ALDH1A1 P00352 2/20 0.32
HTT P42858 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
ALOX15 P16050 1/20 0.30

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
SCHEMBL7652879 0.95 TAS1R3 (0.42) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL2777861 0.87 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL10587923 0.87 TAS1R3 (0.35) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL9019898 0.86 TAS1R3 (0.40) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL996758 0.86 CES2 (0.43) CES2CES1ALDH1A1HTTALOX15
SCHEMBL1657 0.83 CES2 (0.48) CES2CES1ALDH1A1HTTKDM4C
SCHEMBL18774737 0.81 TAS1R3 (0.33) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL6538271 0.80 CES2 (0.46) CES2CES1ALDH1A1HTTALOX15
SCHEMBL10631305 0.80 CES2 (0.38) TAS1R3TAS1R1TAS1R2CES2CES1
SCHEMBL2295776 0.80 ALDH1A1 (0.39) CES2CES1ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357145-A1 C4-CARBOXYLIC ACID-SUBSTITUTED TRYPTAMINE DERIVATIVES AND METHODS OF USING Enveric Biosciences Canada Inc. (CA) 2023-11-09 US disclosed
CN-108698982-B Fluorine atom-containing compound and use thereof 日产化学工业株式会社 2021-07-16 CN disclosed
EP-3404017-B1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL IND LTD (JP) 2020-05-13 EP disclosed
US-10590287-B2 Charge-transporting varnish and organic electroluminescent element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2020-03-17 US disclosed
EP-3252840-B1 VARNISH FOR FORMATION OF CHARGE-TRANSPORTING THIN FILM NISSAN CHEMICAL CORP (JP) 2020-03-11 EP disclosed
EP-3309851-B1 CHARGE-TRANSPORTING VARNISH AND ORGANIC ELECTROLUMINESCENT ELEMENT NISSAN CHEMICAL CORP (JP) 2020-01-01 EP disclosed
CN-107710440-B Charge-transporting varnish and organic electroluminescent element 日产化学工业株式会社 2019-12-24 CN disclosed
US-10336686-B2 Fluorine atom-containing compound and use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-07-02 US disclosed
US-10301484-B2 Varnish for formation of charge-transporting thin film NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-05-28 US disclosed
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-01-31 US disclosed
CN-102993017-B optically active additive, liquid crystal formula and forming method thereof, and liquid crystal display IND TECH RES INST 2015-04-29 CN disclosed
US-8754107-B2 Aminopyrrolidines as chemokine receptor antagonists ABBVIE INC. (US) 2014-06-17 US disclosed
US-8449953-B2 Chiral dopants, liquid crystal matrix and manufacturing method thereof and liquid crystal display INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-05-28 US disclosed
CN-102993017-A Optically active additive, liquid crystal formula and forming method thereof, and liquid crystal display IND TECH RES INST 2013-03-27 CN disclosed
US-20130063693-A1 CHIRAL DOPANTS, LIQUID CRYSTAL MATRIX AND MANUFACTURING METHOD THEREOF AND LIQUID CRYSTAL DISPLAY INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-03-14 US disclosed
US-6828467-B2 Industrial process of the hydrogenolysis of one hydroxyl or methanol group of a fluorinated benzenedimethanol carried out in a solvent in the presence of a catalyst; 2,3,5,6-tetra-fluorobenzyl alcohol from the 4-methyl derivative SHOWA DENKO K.K. (JP) 2004-12-07 US disclosed
EP-1322584-B1 PROCESS FOR PRODUCING FLUORINATED METHYL-BENZYL ALCOHOL SHOWA DENKO KK (JP) 2004-11-24 EP disclosed
US-20040010167-A1 Process for producing fluorinated methyl-benzyl alcohol SHOWA DENKO K.K. (JP) 2004-01-15 US disclosed
EP-1322584-A2 PROCESS FOR PRODUCING FLUORINATED METHYL-BENZYL ALCOHOL Showa Denko K.K. (JP) 2003-07-02 EP disclosed
WO-2002026678-A2 PROCESS FOR PRODUCING FLUORINATED METHYL-BENZYL ALCOHOL SHOWA DENKO K.K. (JP) 2002-04-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10336686-B2 Fluorine atom-containing compound and use thereof ARF1, ARF5, ARFGAP1 TAS1R3 3689/4885TAS1R1 2966/4885TAS1R2 3744/4885
US-20230357145-A1 C4-CARBOXYLIC ACID-SUBSTITUTED TRYPTAMINE DERIVATIVES AND METHODS OF USING HTR4, HTR2C, CNR2 TAS1R3 2205/4885TAS1R1 2659/4885TAS1R2 2507/4885
US-10590287-B2 Charge-transporting varnish and organic electroluminescent element SLCO4C1, SLCO2A1, SLC26A3 TAS1R3 630/4885TAS1R1 562/4885TAS1R2 652/4885
US-20040010167-A1 Process for producing fluorinated methyl-benzyl alcohol ADH1C, ADH5, ADH1A TAS1R3 3075/4885TAS1R1 3662/4885TAS1R2 3716/4885
US-20130063693-A1 CHIRAL DOPANTS, LIQUID CRYSTAL MATRIX AND MANUFACTURING METHOD THEREOF AND LIQUID CRYSTAL DISPLAY CNPY2, YBX3, CCR3 TAS1R3 1214/4885TAS1R1 2344/4885TAS1R2 2094/4885
US-20190031600-A1 FLUORINE ATOM-CONTAINING COMPOUND AND USE THEREOF ARF1, ARF5, ARFGAP1 TAS1R3 3689/4885TAS1R1 2966/4885TAS1R2 3744/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.