SCHEMBL5115259

SCHEMBL5115259

Nc1c(C(=O)O)cc(F)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.44
KEAP1 Q14145 2/20 0.44
NFE2L2 Q16236 1/20 0.42
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
ASPH Q12797 1/20 0.38
KDM8 Q8N371 1/20 0.38
KMT2A Q03164 4/20 0.38
GFER P55789 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 3/20 0.36
THRB P10828 3/20 0.36
CYP3A4 P08684 3/20 0.36
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
CASP7 P55210 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36

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
SCHEMBL28226170 0.87 KDM4E (0.48) KDM4EKEAP1NFE2L2ASPHKDM8
SCHEMBL4591061 0.83 DGAT1 (0.42) CES2CES1KMT2AMAPTALDH1A1
SCHEMBL3226637 0.83 KEAP1 (0.44) KDM4EKEAP1NFE2L2CES2CES1
SCHEMBL29706506 0.83 KEAP1 (0.44) KDM4EKEAP1NFE2L2CES2CES1
SCHEMBL8377311 0.83 KDM4E (0.44) KDM4EKEAP1NFE2L2CES2CES1
SCHEMBL29810948 0.82 KDM4E (0.40) KDM4EKEAP1NFE2L2ASPHKDM8
SCHEMBL21415507 0.82 KDM4E (0.48) KDM4EKEAP1NFE2L2ASPHKDM8
SCHEMBL17030866 0.82 KDM4E (0.40) KDM4EKEAP1NFE2L2ASPHKDM8
SCHEMBL4502539 0.82 KEAP1 (0.47) KDM4EKEAP1NFE2L2CES2CES1
SCHEMBL503374 0.79 KEAP1 (0.47) KDM4EKEAP1NFE2L2CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113604194-A Modified epoxy resin binder for stone and preparation method thereof 湖南柯盛新材料有限公司 2021-11-05 CN claimed
CN-113583606-A Stone binder of polyphenyl ether modified epoxy resin and preparation method thereof 湖南柯盛新材料有限公司 2021-11-02 CN claimed
CN-113528068-A Double-component stone crack sealer and preparation method thereof 湖南柯盛新材料有限公司 2021-10-22 CN claimed
CN-113462338-A Stone binder and preparation method thereof 湖南柯盛新材料有限公司 2021-10-01 CN claimed
CN-113403015-A Double-component stone binder and preparation method thereof 湖南柯盛新材料有限公司 2021-09-17 CN claimed
EP-0968994-B1 PROCESS FOR PRODUCING SUBSTITUTED TRIFLUOROBENZOIC ACIDS AND ESTERS THEREOF UBE INDUSTRIES (JP) 2002-11-06 EP claimed
US-6160171-A Trifluoro-substituted benzoic acid, esters thereof, and process for producing the same UBE INDUSTRIES, LTD. (JP) 2000-12-12 US claimed
EP-0968994-A1 SUBSTITUTED TRIFLUOROBENZOIC ACIDS, ESTERS THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2000-01-05 EP claimed
JP-2178254-A None JP disclosed
US-20220348558-A1 INHIBITORS OF ENCEPHALITIC ALPHAVIRUSES UT RESEARCH FOUNDATION 2022-11-03 US disclosed
CN-113604194-A Modified epoxy resin binder for stone and preparation method thereof 湖南柯盛新材料有限公司 2021-11-05 CN disclosed
CN-113583606-A Stone binder of polyphenyl ether modified epoxy resin and preparation method thereof 湖南柯盛新材料有限公司 2021-11-02 CN disclosed
CN-113528068-A Double-component stone crack sealer and preparation method thereof 湖南柯盛新材料有限公司 2021-10-22 CN disclosed
CN-113462338-A Stone binder and preparation method thereof 湖南柯盛新材料有限公司 2021-10-01 CN disclosed
EP-0968994-B1 PROCESS FOR PRODUCING SUBSTITUTED TRIFLUOROBENZOIC ACIDS AND ESTERS THEREOF UBE INDUSTRIES (JP) 2002-11-06 EP disclosed
WO-2002050019-A2 DIAMINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB PHARMA CO. (US) 2002-06-27 WO disclosed
US-6307091-B1 TRIFLUOROMETHYLATING A TRIFLUOROIODOBENZOIC ACID ESTER WITH ADIFLUORO(FLUOROSULFONYL)ACETIC ACID ESTER IN THE PRESENCE OF A COPPER CATALYST IN AN ORGANIC SOLVENT. UBE INDUSTRIES, LTD. (JP) 2001-10-23 US disclosed
US-6160171-A Trifluoro-substituted benzoic acid, esters thereof, and process for producing the same UBE INDUSTRIES, LTD. (JP) 2000-12-12 US disclosed
EP-0968994-A1 SUBSTITUTED TRIFLUOROBENZOIC ACIDS, ESTERS THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2000-01-05 EP disclosed
JP-H02178254-A IMPROVED SYNTHESIS OF 3-CHLORO-2,4,5-TRIFLUOROBENZOIC ACID WARNER LAMBERT CO 1990-07-11 JP 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 (1 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-20220348558-A1 INHIBITORS OF ENCEPHALITIC ALPHAVIRUSES NEFM, EIF2AK2, PMP22 KDM4E 3589/4885KEAP1 2170/4885NFE2L2 2198/4885

“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.