SCHEMBL2362310

SCHEMBL2362310

Cn1ccc(C(F)(F)C(F)(F)C(F)(F)F)n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
KEAP1 Q14145 1/20 0.33
SCN4A P35499 1/20 0.32
GAA P10253 1/20 0.31
KCNH2 Q12809 1/20 0.31
LRRK2 Q5S007 1/20 0.31
MGLL Q99685 1/20 0.30

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
SCHEMBL2362223 0.94 KMT2A (0.34) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL2354268 0.88 KMT2A (0.38) KMT2AKEAP1SCN4AKCNH2LRRK2
Bicarbonate SCHEMBL2362868 0.79 JMJD6 (0.37) KMT2AKCNH2MGLL
SCHEMBL174430 0.79 PRMT6 (0.41) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL28247297 0.77 PRMT6 (0.40) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL3120354 0.76 KMT2A (0.35) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL1086131 0.75 KMT2A (0.38) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL24050952 0.72 KMT2A (0.35) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL440932 0.72 KMT2A (0.41) KMT2AKEAP1SCN4A
SCHEMBL22932511 0.71 KMT2A (0.38) KMT2AKEAP1SCN4A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103044331-B Prepare the new method of the formamide of 3 n-propyl pyrazoles of silaenafil intermediate 4 amino, 1 methyl 5 常州市亚邦医药研究所有限公司 2017-09-15 CN disclosed
EP-2352723-B1 PESTICIDAL N-ARYL- OR N-HETEROARYL PYRAZOLE CARBOXAMIDE COMPOUNDS BAYER IP GMBH (DE) 2016-11-23 EP disclosed
US-20150099766-A1 Novel halogen-substituted compounds BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-04-09 US disclosed
US-8946234-B2 Halogen-substituted compounds BAYER CROPSCIENCE AG (DE) 2015-02-03 US disclosed
US-8202877-B2 Aminopyrimidinamides as pesticides BAYER CROPSCIENCE AG (DE) 2012-06-19 US disclosed
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents BAYER CROPSCIENCE AG (DE) 2012-03-22 US disclosed
US-20110301181-A1 halogen-substituted compounds BAYER CROPSCIENCE AG (DE) 2011-12-08 US disclosed
EP-2352723-A2 HALOGEN-SUBSTITUTED COMPOUNDS USED AS PESTICIDES Bayer CropScience AG (DE) 2011-08-10 EP disclosed
US-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (US) 2010-11-25 US disclosed
WO-2010051926-A2 NEW HALOGEN-SUBSTITUTED BONDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-05-14 WO disclosed
EP-2184273-A1 Halogen substituted compounds as pesticides Bayer CropScience AG (DE) 2010-05-12 EP 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 (4 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-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES DDT, NPEPPS, PTMS KMT2A 1755/4885KEAP1 1185/4885SCN4A 1109/4885
US-20110301181-A1 halogen-substituted compounds L3MBTL4, QSOX1, L3MBTL3 KMT2A 1177/4885KEAP1 32/4885SCN4A 757/4885
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents NPEPPS, DDT, DNPEP KMT2A 785/4885KEAP1 657/4885SCN4A 1315/4885
US-20150099766-A1 Novel halogen-substituted compounds L3MBTL4, PRDX4, PRDX1 KMT2A 1127/4885KEAP1 29/4885SCN4A 490/4885

“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.