SCHEMBL4428667

SCHEMBL4428667

CCN(C)/C=N/c1cc(C)c(Oc2ccc(F)c(C(F)(F)F)c2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
SLC6A4 P31645 2/20 0.40
KCNH2 Q12809 1/20 0.40
AR P10275 14/20 0.34
BRAF P15056 1/20 0.32
KDR P35968 1/20 0.32
SCN9A Q15858 1/20 0.31
RHEB Q15382 1/20 0.31
PLA2G7 Q13093 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
SCHEMBL1278451 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2ARBRAF
SCHEMBL29427853 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2ARBRAF
SCHEMBL119682 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2ARBRAF
SCHEMBL374922 0.95 HTR2A (0.37) HTR2ASLC6A4KCNH2AR
SCHEMBL12710235 0.92 HTR2A (0.32) HTR2ASLC6A4KCNH2
SCHEMBL12710204 0.91 RHEB (0.35) HTR2ASLC6A4KCNH2ARRHEB
SCHEMBL28347300 0.90 HTR2A (0.41) HTR2ASLC6A4KCNH2ARBRAF
SCHEMBL912518 0.90 HTR2A (0.37) HTR2ASLC6A4KCNH2ARSCN9A
SCHEMBL912517 0.90 HTR2A (0.37) HTR2ASLC6A4KCNH2ARSCN9A
SCHEMBL121354 0.88 SCN9A (0.38) HTR2ASLC6A4KCNH2ARBRAF

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-1562569-B1 ANTIFUNGAL MEDICAMENTS COMPRISING ARYLAMIDINE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2009-12-23 EP claimed
US-20060052459-A1 Antifungal medicaments comprising arylamidine derivatives BAYER SAS (FR) 2006-03-09 US claimed
US-6893650-B1 N2-phenylamidine derivatives BAYER CROPSCIENCE GMBH (DE) 2005-05-17 US claimed
EP-1413301-A1 Antifungal medicaments comprising arylamidine derivatives Bayer CropScience SA (FR) 2004-04-28 EP claimed
EP-1562569-B1 ANTIFUNGAL MEDICAMENTS COMPRISING ARYLAMIDINE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2009-12-23 EP disclosed
US-20060052459-A1 Antifungal medicaments comprising arylamidine derivatives BAYER SAS (FR) 2006-03-09 US disclosed
EP-1413301-A1 Antifungal medicaments comprising arylamidine derivatives Bayer CropScience SA (FR) 2004-04-28 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 (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-20060052459-A1 Antifungal medicaments comprising arylamidine derivatives DPM1, MAN2B1, MANBA HTR2A 1839/4885SLC6A4 732/4885KCNH2 3810/4885

“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.