SCHEMBL675996

SCHEMBL675996

FC(F)(F)c1cc(Cl)c(Cl)nc1Cl

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.37
NOTUM Q6P988 8/20 0.36
XPO1 O14980 2/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ADRB2 P07550 1/20 0.35
KMO O15229 1/20 0.34
CASP3 P42574 1/20 0.33
TRPA1 O75762 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
IDO1 P14902 1/20 0.32

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
SCHEMBL29687228 1.00 PIK3CD (0.37) PIK3CDNOTUMXPO1CYP11B1CYP11B2
SCHEMBL20360347 0.92 PIK3CD (0.33) PIK3CDNOTUMXPO1CYP11B1CYP11B2
SCHEMBL10853416 0.87 PIK3CD (0.40) PIK3CDNOTUMXPO1CYP11B1CYP11B2
SCHEMBL20350717 0.84
SCHEMBL10746403 0.84 XPO1 (0.31) NOTUMXPO1
SCHEMBL28454953 0.82 NOTUM (0.35) PIK3CDNOTUMCYP11B1CYP11B2CASP3
SCHEMBL21670482 0.82 NOTUM (0.35) PIK3CDNOTUMXPO1CYP11B1CYP11B2
SCHEMBL30285322 0.82 NOTUM (0.35) PIK3CDNOTUMXPO1CYP11B1CYP11B2
SCHEMBL31717937 0.80 PIK3CD (0.41) PIK3CDNOTUMXPO1ADRB2CASP3
SCHEMBL7784302 0.80 PIK3CD (0.41) PIK3CDNOTUMXPO1ADRB2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113717095-A Method for preparing 2-chloro-3-trifluoromethylpyridine and 2-chloro-5-trifluoromethylpyridine 山东汇盟生物科技股份有限公司 2021-11-30 CN claimed
CN-112441966-A Method for producing 2-chloro-3-trifluoromethylpyridine from 2,3, 6-trichloro-5-trifluoromethylpyridine 山东省农药科学研究院 2021-03-05 CN claimed
CN-112159350-A Preparation method of 2-chloro-3-trifluoromethylpyridine 山东省农药科学研究院 2021-01-01 CN claimed
CN-111574439-A Method for preparing 2-amino-3 chloro-5-trifluoromethylpyridine 山东汇盟生物科技有限公司 2020-08-25 CN claimed
US-20180194728-A1 METHOD FOR PREPARING PENTACHLOROPYRIDINE BY UTIILIZING DCTF RECTIFYING SHORT STEAMING RESIDUES YANCHENG INSTITUTE OF TECHNOLOGY 2018-07-12 US claimed
US-10017473-B1 Method for preparing pentachloropyridine by utilizing DCTF rectifying short steaming residues YANCHENG INST TECH (CN) 2018-07-10 US claimed
EP-0078410-B1 PROCESS FOR PRODUCING 3-CHLORO-5-TRIFLUOROMETHYLPYRIDINES ISHIHARA SANGYO KAISHA, LTD. (JP) 1987-05-27 EP claimed
US-4490534-A CHLORINATION IN VAPOR PHASE, PRESENCE OF CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1984-12-25 US claimed
US-4420618-A CHLORINATION, METAL CHLORIDE CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-12-13 US claimed
EP-0078410-A2 Process for producing 3-chloro-5-trifluoromethylpyridines ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-05-11 EP claimed
CN-117263854-A Preparation method of 2,5, 6-trichloronicotinic acid 山东友聚医药科技有限公司 2023-12-22 CN disclosed
CN-110475764-B Method for purifying trifluoromethylpyridines 石原产业株式会社 2023-03-31 CN disclosed
CN-115784977-A Synthesis process of 2-chloro-3-trifluoromethylpyridine 淄博新农基作物科学有限公司 2023-03-14 CN disclosed
EP-3608309-B1 METHOD FOR PURIFYING TRIFLUOROMETHYLPYRIDINE COMPOUND ISHIHARA SANGYO KAISHA (JP) 2022-07-13 EP disclosed
CN-114292227-A Method for preparing 2-chloro-3-trifluoromethylpyridine 大连九信精细化工有限公司 2022-04-08 CN disclosed
US-4490534-A CHLORINATION IN VAPOR PHASE, PRESENCE OF CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1984-12-25 US disclosed
US-4420618-A CHLORINATION, METAL CHLORIDE CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-12-13 US disclosed
US-4420618-A CHLORINATION, METAL CHLORIDE CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-12-13 US disclosed
EP-0092117-A1 Process for producing chloronicotinic acid compounds ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-10-26 EP disclosed
EP-0078410-A2 Process for producing 3-chloro-5-trifluoromethylpyridines ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-05-11 EP disclosed