SCHEMBL28337825

SCHEMBL28337825

CN(CC(=O)c1cc(Br)cc(Br)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl)N(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.40
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ LMNA P02545 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
SCHEMBL28464126 0.92 DHODH (0.36) DHODHMEN1KMT2ALMNA
SCHEMBL17750084 0.89 DHODH (0.39) DHODHMEN1KMT2ALMNA
SCHEMBL28466911 0.87 DHODH (0.36) DHODHMEN1KMT2ALMNA
SCHEMBL13726893 0.87 DHODH (0.37) DHODHMEN1KMT2ALMNA
SCHEMBL30978012 0.87 DHODH (0.37) DHODHMEN1KMT2ALMNA
SCHEMBL28466995 0.86 DHODH (0.39) DHODHMEN1KMT2ALMNA
SCHEMBL15741755 0.85 DHODH (0.40) DHODHMEN1KMT2ALMNA
SCHEMBL10028784 0.85 DHODH (0.41) DHODHMEN1KMT2ALMNA
SCHEMBL951388 0.84 DHODH (0.40) DHODHMEN1KMT2ALMNA
SCHEMBL12528079 0.84 DHODH (0.39) DHODHMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113993847-A Fungicidal N- (pyridin-3-yl) carboxamides 巴斯夫欧洲公司 2022-01-28 — — CN disclosed
CN-111683933-A Novel pyridine carboxamides 巴斯夫欧洲公司 2020-09-18 — — CN disclosed
CN-110621669-A Substituted 5-haloalkyl-5-hydroxyisoxazoles for controlling phytopathogenic fungi 巴斯夫欧洲公司 2019-12-27 — — CN disclosed
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