SCHEMBL910774

SCHEMBL910774

CCN(C)C=Nc1cc(C(F)(F)F)c(Oc2ccc(Cl)c(C(C)(C)C)c2)cc1C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.35
HTR2A P28223 6/20 0.35
SLC6A4 P31645 6/20 0.35
KCNH2 Q12809 6/20 0.35
AR P10275 5/20 0.32
PLA2G7 Q13093 3/20 0.32
RHEB Q15382 1/20 0.31
ESRRA P11474 1/20 0.31

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
SCHEMBL3299887 1.00 SCN9A (0.35) SCN9AHTR2ASLC6A4KCNH2AR
SCHEMBL910773 1.00 SCN9A (0.35) SCN9AHTR2ASLC6A4KCNH2AR
SCHEMBL3302720 0.95 SCN9A (0.39) SCN9AHTR2ASLC6A4KCNH2AR
SCHEMBL3302723 0.95 SCN9A (0.39) SCN9AHTR2ASLC6A4KCNH2AR
SCHEMBL912135 0.91 HTR2A (0.33) HTR2ASLC6A4KCNH2ESRRA
SCHEMBL912134 0.91 HTR2A (0.33) HTR2ASLC6A4KCNH2ESRRA
SCHEMBL2336047 0.91 ESRRA (0.34) SCN9AHTR2ASLC6A4KCNH2ESRRA
SCHEMBL2340382 0.91 HTR2A (0.33) HTR2ASLC6A4KCNH2ESRRA
SCHEMBL2336045 0.91 ESRRA (0.34) SCN9AHTR2ASLC6A4KCNH2ESRRA
SCHEMBL121354 0.90 SCN9A (0.38) SCN9AHTR2ASLC6A4KCNH2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134170-B1 FLUORALKYLPHENYLAMIDINES AND THEIR USE AS FUNGICIDES BAYER IP GMBH (DE) 2015-06-03 EP claimed
US-8299301-B2 Fluoralkylphenylamidines and the use thereof as fungicides BAYER CROPSCIENCE AG (DE) 2012-10-30 US claimed
US-20110003689-A1 USE OF POLYMERIC GUANIDINE DERIVATIVES FOR THE CONTROL OF UNWANTED MICROORGANISMS IN CROP PROTECTION AKA TECHNOLOGY GMBH (AT) 2011-01-06 US claimed
US-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-15 US claimed
EP-2014167-A1 Active compound combinations Bayer CropScience AG (DE) 2009-01-14 EP claimed
EP-1969931-A1 Fluoroalkyl phenylamidines and their use as fungicides Bayer CropScience Aktiengesellschaft (DE) 2008-09-17 EP claimed
EP-2134170-B1 FLUORALKYLPHENYLAMIDINES AND THEIR USE AS FUNGICIDES BAYER IP GMBH (DE) 2015-06-03 EP disclosed
US-8299301-B2 Fluoralkylphenylamidines and the use thereof as fungicides BAYER CROPSCIENCE AG (DE) 2012-10-30 US disclosed
US-20110003689-A1 USE OF POLYMERIC GUANIDINE DERIVATIVES FOR THE CONTROL OF UNWANTED MICROORGANISMS IN CROP PROTECTION AKA TECHNOLOGY GMBH (AT) 2011-01-06 US disclosed
US-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-15 US disclosed
EP-2071954-A1 Use of polymeric guanidine derivatives for combating unwanted micro-organisms in the protection of plants Bayer CropScience AG (DE) 2009-06-24 EP disclosed
EP-2014167-A1 Active compound combinations Bayer CropScience AG (DE) 2009-01-14 EP disclosed
EP-1969931-A1 Fluoroalkyl phenylamidines and their use as fungicides Bayer CropScience Aktiengesellschaft (DE) 2008-09-17 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-20110003689-A1 USE OF POLYMERIC GUANIDINE DERIVATIVES FOR THE CONTROL OF UNWANTED MICROORGANISMS IN CROP PROTECTION GDA, GMPS, GANC SCN9A 3590/4885HTR2A 2990/4885SLC6A4 3186/4885
US-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES PFAS, DDT, PAH SCN9A 3670/4885HTR2A 1767/4885SLC6A4 1427/4885

“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.