SCHEMBL17514769

SCHEMBL17514769

N#Cc1cc(F)c(-c2ccc[c]c2Cl)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 3/20 0.36
CYP11B2 P19099 2/20 0.35
GRM5 P41594 2/20 0.33
ACLY P53396 2/20 0.33
KIF11 P52732 1/20 0.30
CYP11B1 P15538 1/20 0.30
AR P10275 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
SCHEMBL17514812 0.84 EGLN2 (0.38) EGLN2
SCHEMBL17514682 0.83 EGLN2 (0.34) EGLN2GRM5ACLYKIF11
SCHEMBL17514882 0.82 PDK2 (0.30)
SCHEMBL17514725 0.79 PDK2 (0.31)
SCHEMBL17514605 0.79 CHRM5 (0.30)
SCHEMBL17514920 0.78 EGLN2 (0.36) EGLN2GRM5ACLYCYP11B1
SCHEMBL2053601 0.78 CA1 (0.35)
SCHEMBL17514925 0.78 EGLN2 (0.34) EGLN2
SCHEMBL17514732 0.78 EGLN2 (0.35) EGLN2GRM5KIF11
SCHEMBL17514800 0.78 EGLN2 (0.32) EGLN2GRM5ACLY

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
WO-2016026830-A1 NOVEL FUNGICIDAL PYRAZOLE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-02-25 WO disclosed