SCHEMBL2362223

SCHEMBL2362223

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

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.34
KEAP1 Q14145 1/20 0.32
SCN4A P35499 1/20 0.31
KCNH2 Q12809 1/20 0.30
LRRK2 Q5S007 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
SCHEMBL2362310 0.94 KMT2A (0.35) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL2354268 0.86 KMT2A (0.38) KMT2AKEAP1SCN4AKCNH2LRRK2
Bicarbonate SCHEMBL2362868 0.78 JMJD6 (0.37) KMT2AKCNH2
SCHEMBL174430 0.77 PRMT6 (0.41) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL28247297 0.75 PRMT6 (0.40) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL3120354 0.74 KMT2A (0.35) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL1086131 0.74 KMT2A (0.38) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL24050952 0.71 KMT2A (0.35) KMT2AKEAP1SCN4AKCNH2LRRK2
SCHEMBL440932 0.70 KMT2A (0.41) KMT2AKEAP1SCN4A
SCHEMBL22932511 0.69 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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 (2 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-20110301181-A1 halogen-substituted compounds L3MBTL4, QSOX1, L3MBTL3 KMT2A 1177/4885KEAP1 32/4885SCN4A 757/4885
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.