SCHEMBL2986241

SCHEMBL2986241

FC(F)(F)c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 7/20 0.46
IDO1 P14902 2/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
KDR P35968 1/20 0.41
MAPK1 P28482 1/20 0.38
AHR P35869 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.36
PDK1 Q15118 1/20 0.36
NPFFR2 Q9Y5X5 2/20 0.35
NPFFR1 Q9GZQ6 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
SCHEMBL30100590 1.00 NOTUM (0.46) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL11602223 0.94 NOTUM (0.44) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL16699742 0.91 NOTUM (0.47) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL1043062 0.88 NOTUM (0.41) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL11602077 0.83 CYP3A4 (0.46) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL7272204 0.81 NOTUM (0.42) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL8462010 0.81 HTR3E (0.41) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL10830423 0.81 HTR3E (0.38) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL10493649 0.79 RAPGEF4 (0.43) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL9244738 0.79 RAPGEF4 (0.43) NOTUMIDO1HTR3EHTR3BHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116143633-A Method for preparing 2, 5-dichloro-4-trifluoromethyl aniline 浙江巍华新材料股份有限公司 2023-05-23 CN claimed
CN-106866426-B A kind of method of comprehensive utilization for the by-product 2,4,5- trichlorobenzotrifluorides producing 3,4,5-Trichloro-trifluoromethyl-benzene 浙江巍华化工有限公司 2018-08-10 CN claimed
CN-106866426-A A kind of method of comprehensive utilization of the trichlorobenzotrifluoride of accessory substance 2,4,5 for producing 3,4,5 trichlorobenzotrifluorides 浙江巍华化工有限公司 2017-06-20 CN claimed
EP-1528052-B1 Process for the production of 4-amino-3,5-dichlorobenzotrifluoride with high purity commercial products being obtained in parallel FINCHIMICA SRL (IT) 2013-07-31 EP claimed
CN-101891675-B Production method of 6-chloro-2-(trichloromethyl)pyridine DONGYANG YINGRUOHUA GREEN ELECTROCHEMISTRY CO LTD OF HENGDIAN GROUP 2011-12-14 CN claimed
CN-101891675-A Production method of 6-chloro-2-(trichloromethyl)pyridine DONGYANG YINGRUOHUA GREEN ELECTROCHEMISTRY CO LTD OF HENGDIAN GROUP 2010-11-24 CN claimed
EP-1528052-A1 Process for the production of 4-amino-3,5-dichlorobenzotrifluoride with high purity commercial products being obtained in parallel FINCHIMICA S.p.A. (IT) 2005-05-04 EP claimed
US-4885415-A HYDROGENATION, DECHLORINATION, CATALYSIS BAYER AKTIENGESELLSCHAFT (DE) 1989-12-05 US claimed
CN-106892792-B Continuous synthesis method and equipment of 3, 4-dichloro benzotrifluoride 山东道可化学有限公司 2023-05-23 CN disclosed
CN-116143633-A Method for preparing 2, 5-dichloro-4-trifluoromethyl aniline 浙江巍华新材料股份有限公司 2023-05-23 CN disclosed
CN-116143633-A Method for preparing 2, 5-dichloro-4-trifluoromethyl aniline 浙江巍华新材料股份有限公司 2023-05-23 CN disclosed
CN-109970507-B Continuous production method and continuous production equipment for 3, 4-dichlorobenzotrifluoride 山东道可化学有限公司 2022-09-27 CN disclosed
CN-209901249-U 3, 4-dichloro benzotrifluoride continuous production equipment 山东道可化学有限公司 2020-01-07 CN disclosed
CN-106866426-B A kind of method of comprehensive utilization for the by-product 2,4,5- trichlorobenzotrifluorides producing 3,4,5-Trichloro-trifluoromethyl-benzene 浙江巍华化工有限公司 2018-08-10 CN disclosed
US-7777079-B2 Preparation method of 2, 6-dichlor-4-trifluoromethyl aniline ZHEJIANG WEIHUA CHEMICAL CO., LTD. (CN) 2010-08-17 US disclosed
US-20090240083-A1 Preparation Method of 2, 6-Dichlor-4-Trifluoromethyl Aniline ZHEJIANG WEIHUA CHEMICAL CO., LTD. (CN) 2009-09-24 US disclosed
CN-101289400-A Process for synthesizing 2,6- dichlor-4-trifluoromethyl aniline ZHEJIANG WEIHUA CHEMICAL CO LT (CN) 2008-10-22 CN disclosed
EP-1528052-A1 Process for the production of 4-amino-3,5-dichlorobenzotrifluoride with high purity commercial products being obtained in parallel FINCHIMICA S.p.A. (IT) 2005-05-04 EP disclosed
EP-1528052-A1 Process for the production of 4-amino-3,5-dichlorobenzotrifluoride with high purity commercial products being obtained in parallel FINCHIMICA S.p.A. (IT) 2005-05-04 EP disclosed
US-4226783-A OF SIDE CHAINS OF ELECTRONEGATIVELY SUBSTITUTED AROMATIC COMPOUNDS WITH DICHLORINE MONOXIDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-10-07 US 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-20090240083-A1 Preparation Method of 2, 6-Dichlor-4-Trifluoromethyl Aniline DCAF7, APOBEC3C, DDT NOTUM 994/4885IDO1 729/4885HTR3E 2805/4885

“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.