SCHEMBL23865260

SCHEMBL23865260

CN1CCc2cc(Cl)c(Br)cc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ AHR P35869 1/20 0.49
▸ GRM5 P41594 1/20 0.43
▸ DDB1 Q16531 1/20 0.37
▸ CRBN Q96SW2 1/20 0.37
▸ AOC3 Q16853 2/20 0.36

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
SCHEMBL25308853 0.77 MEN1 (0.54) MEN1KMT2AGRM5DDB1CRBN
SCHEMBL31034869 0.77 MEN1 (0.54) MEN1KMT2AGRM5DDB1CRBN
SCHEMBL21939251 0.77 MEN1 (0.54) MEN1KMT2AGRM5DDB1CRBN
SCHEMBL31260453 0.76 MEN1 (0.79) MEN1KMT2AGRM5
SCHEMBL23997079 0.75 MEN1 (0.51) MEN1KMT2AGRM5DDB1CRBN
SCHEMBL8227244 0.74 MEN1 (0.62) MEN1KMT2AGRM5DDB1CRBN
SCHEMBL19887444 0.74 AHR (0.41) MEN1KMT2AAHRGRM5
SCHEMBL30038949 0.74 MEN1 (0.50) MEN1KMT2AGRM5AOC3
SCHEMBL172065 0.73 GRM5 (0.56) MEN1KMT2AGRM5AOC3
SCHEMBL31743068 0.73 GRM5 (0.56) MEN1KMT2AGRM5AOC3

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
EP-3572401-B1 ASK1 INHIBITOR AND PREPARATION METHOD AND USE THEREOF FUJIAN COSUNTER PHARMACEUTICAL CO LTD (CN) 2021-09-29 — — EP disclosed
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