SCHEMBL3455519

SCHEMBL3455519

COc1c(F)c(F)c(C[C@@]2(C(=O)O)C(C=C(Cl)Cl)C2(C)C)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 4/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL2058788 0.90 IMPDH2 (0.34) IMPDH2
SCHEMBL10491028 0.89 MEN1 (0.31) MEN1KMT2ATDP1
SCHEMBL11047042 0.89 MEN1 (0.31) MEN1KMT2ATDP1
SCHEMBL5853620 0.87 MEN1 (0.34) MEN1KMT2ATDP1
SCHEMBL10325858 0.87 MEN1 (0.34) MEN1KMT2ATDP1
SCHEMBL17511081 0.87 MEN1 (0.34) MEN1KMT2ATDP1
SCHEMBL441129 0.85 MEN1 (0.39) MEN1KMT2ATDP1
SCHEMBL29006392 0.85 IMPDH2 (0.32) IMPDH2
SCHEMBL7924335 0.85 IMPDH2 (0.32) IMPDH2
SCHEMBL7924333 0.85 IMPDH2 (0.32) IMPDH2

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-2010124496-A1 AN INSECTICIDAL INCENSE, THE PREPARATION AND THE USE THEREOF 江苏扬农化工股份有限公司 (CN) 2010-11-04 WO disclosed