SCHEMBL31034869

SCHEMBL31034869

CN1CCc2cc(Br)c(N)cc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ GRM5 P41594 1/20 0.43
▸ AOC3 Q16853 2/20 0.39
▸ TYMS P04818 1/20 0.39
▸ DDB1 Q16531 1/20 0.37
▸ CRBN Q96SW2 1/20 0.37
▸ OPRD1 P41143 1/20 0.35

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 1.00 MEN1 (0.54) MEN1KMT2AGRM5AOC3TYMS
SCHEMBL29010819 0.83 MEN1 (0.39) MEN1KMT2ATYMSDDB1CRBN
SCHEMBL31391626 0.83 MEN1 (0.39) MEN1KMT2ATYMSDDB1CRBN
SCHEMBL31260453 0.79 MEN1 (0.79) MEN1KMT2AGRM5
SCHEMBL24869723 0.78 MEN1 (0.77) MEN1KMT2AGRM5AOC3
SCHEMBL30875685 0.78 MEN1 (0.77) MEN1KMT2AGRM5AOC3
SCHEMBL23865260 0.77 MEN1 (0.54) MEN1KMT2AGRM5AOC3DDB1
SCHEMBL21939251 0.77 MEN1 (0.54) MEN1KMT2AGRM5AOC3DDB1
SCHEMBL25947321 0.77 MEN1 (0.50) MEN1KMT2AGRM5AOC3DDB1
SCHEMBL18053937 0.75 GRM5 (0.57) MEN1KMT2AGRM5AOC3DDB1

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
CN-118434729-A Fused ring compounds as HPK1 inhibitors 微境生物医药科技(上海)有限公司 2024-08-02 — — CN disclosed
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