SCHEMBL14495164

SCHEMBL14495164

COC(=O)NN(C)C(=O)c1cc(Cl)cc(C)c1N(C)C(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ MALT1 Q9UDY8 10/20 0.34
▸ RBP4 P02753 1/20 0.33
▸ SMO Q99835 1/20 0.31
▸ TRPA1 O75762 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
SCHEMBL29019794 0.88 DHODH (0.40) DHODHMALT1TRPA1
SCHEMBL14495255 0.88 DHODH (0.39) DHODHMALT1RBP4
SCHEMBL29735411 0.87 DHODH (0.40) DHODHMALT1RBP4
SCHEMBL121150 0.87 DHODH (0.40) DHODHMALT1RBP4
SCHEMBL17673113 0.86 DHODH (0.37) DHODHMALT1
SCHEMBL28455051 0.85 DHODH (0.42) DHODHMALT1
SCHEMBL28460689 0.85 DHODH (0.40) DHODHMALT1
SCHEMBL28460686 0.85 DHODH (0.38) DHODHMALT1
SCHEMBL28455295 0.84 DHODH (0.38) DHODHMALT1TRPA1
SCHEMBL12559625 0.84 DHODH (0.40) DHODHMALT1RBP4

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-2007043677-A9 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2007-06-07 — — WO disclosed
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