SCHEMBL3309490

SCHEMBL3309490

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.33
SLC6A4 P31645 5/20 0.33
KCNH2 Q12809 4/20 0.33
THRB P10828 1/20 0.31
RORC P51449 1/20 0.31
G6PD P11413 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
SCHEMBL912743 1.00 HTR2A (0.33) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL912742 1.00 HTR2A (0.33) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL3308813 0.91 HTR2A (0.40) HTR2ASLC6A4KCNH2
SCHEMBL3308733 0.91 HTR2A (0.40) HTR2ASLC6A4KCNH2
SCHEMBL912272 0.90 HTR2A (0.35) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL912271 0.90 HTR2A (0.35) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL22176951 0.87 RORC (0.38) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL913233 0.87 AR (0.35) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL913232 0.87 AR (0.35) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL913198 0.87 HTR2A (0.30) HTR2ASLC6A4KCNH2

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 5 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-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-15 US claimed
US-8299301-B2 Fluoralkylphenylamidines and the use thereof as fungicides BAYER CROPSCIENCE AG (DE) 2012-10-30 US disclosed
US-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-04-15 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-20100093534-A1 FLUORALKYLPHENYLAMIDINES AND THE USE THEREOF AS FUNGICIDES PFAS, DDT, PAH HTR2A 1767/4885SLC6A4 1427/4885KCNH2 1028/4885

“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.