SCHEMBL720136

SCHEMBL720136

N#Cc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.59
GAA P10253 5/20 0.59
HTT P42858 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
PKM P14618 1/20 0.47
KDM4E B2RXH2 3/20 0.46
POLB P06746 2/20 0.46
PLAU P00749 1/20 0.46
MAPT P10636 3/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 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
SCHEMBL12724970 0.81 ALDH1A1 (0.46) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL17180597 0.81 ALDH1A1 (0.64) ALDH1A1GAAHTTL3MBTL1KMT2A
SCHEMBL6210015 0.81 ALDH1A1 (0.59) ALDH1A1GAAHTTL3MBTL1KMT2A
SCHEMBL2169173 0.79 ALDH1A1 (0.50) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL6033856 0.79 ALDH1A1 (0.50) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL24423759 0.79 ALDH1A1 (0.42) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL29585372 0.79 ALDH1A1 (0.42) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL11123776 0.78 ALDH1A1 (0.49) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL6497412 0.78 ALDH1A1 (0.49) ALDH1A1GAAHTTL3MBTL1MEN1
SCHEMBL16666241 0.78 ALDH1A1 (0.58) ALDH1A1GAAHTTL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735764-B Method for recovering 2-cyano-3-chloro-5-trifluoromethylpyridine rectifying still residue 内蒙古佳瑞米精细化工有限公司 2023-03-31 CN claimed
CN-114478365-A Purification method of 2-aminomethyl-3-chloro-5-trifluoromethylpyridine acetate 大连九信作物科学有限公司 2022-05-13 CN claimed
CN-112390748-B Preparation method of 2-cyano-3-fluoro-5-trifluoromethylpyridine 内蒙古佳瑞米精细化工有限公司 2022-04-26 CN claimed
CN-215946780-U 2-cyano-3-chlorine-5-trifluoromethyl pyridine byproduct potassium fluoride recovery unit 内蒙古佳瑞米精细化工有限公司 2022-03-04 CN claimed
CN-113735764-A Method for recovering 2-cyano-3-chloro-5-trifluoromethylpyridine rectifying still residue 内蒙古佳瑞米精细化工有限公司 2021-12-03 CN claimed
CN-213493653-U 2-cyano-3-chlorine-5-trifluoromethyl pyridine continuous reaction device 内蒙古佳瑞米精细化工有限公司 2021-06-22 CN claimed
CN-112552231-A Synthetic method of 2- (3-chloro-5- (trifluoromethyl) pyridine-2-yl) ethylamine 南京正荣医药化学有限公司 2021-03-26 CN claimed
CN-112390748-A Preparation method of 2-cyano-3-fluoro-5-trifluoromethylpyridine 内蒙古佳瑞米精细化工有限公司 2021-02-23 CN claimed
CN-112390747-A Combined preparation method of 2-cyano-3-chloro-5-trifluoromethylpyridine and succinonitrile 内蒙古佳瑞米精细化工有限公司 2021-02-23 CN claimed
CN-112390746-A Method for inhibiting generation of 2-cyano-3-chloro-5-trifluoromethylpyridine precursor impurity 内蒙古佳瑞米精细化工有限公司 2021-02-23 CN claimed
US-7456290-B2 Process for the preparation of 2-aminomethylpyridine derivative BAYER CROPSCIENCE S.A. (FR) 2008-11-25 US claimed
EP-1311483-B1 PROCESS FOR THE PREPARATION OF 2-AMINOMETHYL-HALOGEN-PYRIDINES BAYER CROPSCIENCE SA (FR) 2006-12-20 EP claimed
US-6921828-B2 Processes for the preparation of 2-aminomethlpyridines and the 2-cyanopyridines used in their preparation BAYER CROPSCIENCE S.A. (FR) 2005-07-26 US claimed
US-20040049048-A1 Novel process BAYER CROPSCIENCE LIMITED (GB) 2004-03-11 US claimed
EP-1311483-A2 PROCESS FOR THE PREPARATION OF 2-AMINOMETHYLPYRIDINES Bayer CropScience S.A. (FR) 2003-05-21 EP claimed
EP-1199305-A1 Process for the preparation of 2-aminomethylpyridines AVENTIS CROPSCIENCE S.A. (FR) 2002-04-24 EP claimed
WO-2002016322-A2 PROCESS FOR THE PREPARATION OF 2-AMINOETHYLPYRIDINES BAYER CROPSCIENCE SA (FR) 2002-02-28 WO claimed
EP-0034917-B1 2-SUBSTITUTED-5-TRIFLUOROMETHYLPYRIDINES AND A PROCESS FOR PRODUCING THE SAME ISHIHARA SANGYO KAISHA LTD. (JP) 1984-08-08 EP claimed
US-4367336-A 2-Substituted-5-trifluoromethylpyridines and process for producing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-01-04 US claimed
EP-0034917-A1 2-Substituted-5-trifluoromethylpyridines and a process for producing the same ISHIHARA SANGYO KAISHA LTD. (JP) 1981-09-02 EP claimed

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-20040049048-A1 Novel process UGT1A4, SULT1A1, CYP4A11 ALDH1A1 93/4885GAA 158/4885HTT 2861/4885

“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.