SCHEMBL9214484

SCHEMBL9214484

CC(NC(=O)C(C#N)C(C)(C)C)c1ccc(Br)cc1Cl

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
Diclocymet SCHEMBL8921616 0.88 MEN1 (0.50) MEN1KMT2A
Diclocymet SCHEMBL4165786 0.88 MEN1 (0.50) MEN1KMT2A
Diclocymet SCHEMBL42437 0.88 MEN1 (0.50) MEN1KMT2A
Diclocymet SCHEMBL674273 0.88 MEN1 (0.50) MEN1KMT2A
Diclocymet SCHEMBL674274 0.88 MEN1 (0.50) MEN1KMT2A
SCHEMBL10427430 0.79 SMN1; SMN2 (0.48)
Diclocymet SCHEMBL6052765 0.78 MEN1 (0.42) MEN1KMT2A
SCHEMBL15144396 0.78 MEN1 (0.48) MEN1KMT2A
SCHEMBL22660107 0.76 MAPK1 (0.50) MAPK1MEN1KMT2A
SCHEMBL22660106 0.76 MAPK1 (0.50) MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7138107-A None JP disclosed
JP-H07138107-A AGRICULTURAL AND HORTICULTURAL FUNGICIDAL COMPOSITION SUMITOMO CHEM CO LTD 1995-05-30 JP disclosed