SCHEMBL330603

SCHEMBL330603

Cc1c(N)cccc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
CYP3A4 P08684 2/20 0.56
PIK3CA P42336 1/20 0.56
ALDH1A1 P00352 2/20 0.46
TAS2R14 Q9NYV8 1/20 0.40
CD44 P16070 1/20 0.39
MPL P40238 2/20 0.39
NOTUM Q6P988 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ESR1 P03372 1/20 0.37
KCNH2 Q12809 1/20 0.37
HSD11B1 P28845 1/20 0.37
P2RX7 Q99572 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CTSS P25774 1/20 0.36
PARP1 P09874 1/20 0.36
GLA P06280 1/20 0.35
GAA P10253 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
Benzene SCHEMBL28248705 0.98 TSHR (0.54) TSHRCYP3A4PIK3CAALDH1A1TAS2R14
SCHEMBL27390124 0.84 CYP3A4 (0.54) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL6630838 0.83 TAS2R14 (0.46) ALDH1A1TAS2R14MPLNOTUMTDP1
SCHEMBL8165870 0.83 CYP3A4 (0.52) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL27749301 0.82 ESR1 (0.43) TSHRCYP3A4PIK3CAALDH1A1TAS2R14
SCHEMBL9016041 0.79 CYP3A4 (0.48) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL8173503 0.79 CYP3A4 (0.59) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL29871801 0.79 CYP3A4 (0.59) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL5163816 0.79 CYP3A4 (0.59) TSHRCYP3A4PIK3CAALDH1A1CD44
SCHEMBL27277801 0.78 CYP3A4 (0.46) TSHRCYP3A4PIK3CAALDH1A1CD44

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115710217-B Flunixin meglumine synthesis method suitable for industrial production 江苏恒盛药业有限公司 2025-06-13 CN claimed
CN-222872169-U Reaction kettle for synthesizing 2-methyl-3-trifluoromethyl aniline 福建盛煌生物医药科技有限公司 2025-05-16 CN claimed
CN-119874539-A Crystal form of 2-methyl-3-trifluoromethyl aniline and synthesis method 福建永晶科技股份有限公司 2025-04-25 CN claimed
CN-119707699-A Preparation method of 2-methyl-3-trifluoromethyl aniline 三明学院 2025-03-28 CN claimed
CN-115073298-B Method for synthesizing 2-methyl-3-trifluoromethyl aniline by continuous flow microreactor 湖南华腾制药有限公司 2024-12-27 CN claimed
CN-116813537-B Preparation method and application of novel flunixin hapten 深圳市绿诗源生物技术有限公司 2024-09-17 CN claimed
CN-118496066-A 1-Bromo-4-methoxy-3-methyl-2- (trifluoromethyl) benzene and preparation method thereof 苏州汉德创宏生化科技有限公司 2024-08-16 CN claimed
CN-117886700-A Preparation method of 2-methyl-3-trifluoromethyl aniline 福建永晶科技股份有限公司 2024-04-16 CN claimed
CN-117843494-A Method for preparing 2-methyl-3-trifluoromethyl aniline 和鼎(南京)医药技术有限公司 2024-04-09 CN claimed
CN-117843497-A Method for preparing 2-methyl-3-trifluoromethyl aniline 和鼎(南京)医药技术有限公司 2024-04-09 CN claimed
US-5449831-A Process of preparing 2-methyl-3-aminobenzotrifluoride CENTRAL GLASS COMPANY, LIMITED (JP) 1995-09-12 US claimed
EP-0619809-A1 PROCESS FOR PREPARING FLUNIXIN AND INTERMEDIATES THEREOF. SCHERING CORP (US) 1994-10-19 EP claimed
US-5349104-A Base stabilized compound for heat resistance and storage stability HOECHST AKTIENGESELLSCHAFT (DE) 1994-09-20 US claimed
EP-0568977-A2 Stabilized aminobenzotrifluorides HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-10 EP claimed
WO-1993013070-A1 PROCESS FOR PREPARING FLUNIXIN AND INTERMEDIATES THEREOF SCHERING CORPORATION (US) 1993-07-08 WO claimed
US-4831193-A Synthesis of 3-amino-2-methylbenzotrifluoride SCHERING CORPORATION (US) 1989-05-16 US claimed
CN-1030073-A The novel synthesis of 3-amino-2-methyl phenylfluoroform SCHERING CORP (US) 1989-01-04 CN claimed
WO-1988010247-A1 NOVEL SYNTHESIS OF 3-AMINO-2-METHYLBENZOTRIFLUORIDE SCHERING CORPORATION (US) 1988-12-29 WO claimed
EP-0295674-A1 Novel synthesis of 3-amino-2-methylbenzotrifluoride SCHERING CORPORATION (US) 1988-12-21 EP claimed
US-4209464-A Novel synthesis of 3-amino-2-methylbenzotrifluoride from N-(2-X-5-trifluoromethylphenyl)-S,S-dimethylsulfimide SCHERING CORPORATION (US) 1980-06-24 US claimed