SCHEMBL374922

SCHEMBL374922

CCN(C)C=Nc1cc(C)c(Oc2ccc(F)c(C(F)(F)F)c2)cc1C.N=CN

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37
KCNH2 Q12809 1/20 0.37
AR P10275 4/20 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
SCHEMBL119682 0.95 HTR2A (0.40) HTR2ASLC6A4KCNH2AR
SCHEMBL4428667 0.95 HTR2A (0.40) HTR2ASLC6A4KCNH2AR
SCHEMBL29427853 0.95 HTR2A (0.40) HTR2ASLC6A4KCNH2AR
SCHEMBL1278451 0.95 HTR2A (0.40) HTR2ASLC6A4KCNH2AR
SCHEMBL12710235 0.87 HTR2A (0.32) HTR2ASLC6A4KCNH2
SCHEMBL12710204 0.87 RHEB (0.35) HTR2ASLC6A4KCNH2AR
SCHEMBL28347300 0.86 HTR2A (0.41) HTR2ASLC6A4KCNH2AR
SCHEMBL912518 0.85 HTR2A (0.37) HTR2ASLC6A4KCNH2AR
SCHEMBL912517 0.85 HTR2A (0.37) HTR2ASLC6A4KCNH2AR
SCHEMBL1278450 0.84 SCN9A (0.38) HTR2ASLC6A4KCNH2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2409570-A2 Fungicidal mixtures based on pyrazolopyridine compounds BASF SE (DE) 2012-01-25 EP disclosed