SCHEMBL27359540

SCHEMBL27359540

Cc1ccc(-c2cnc(Nc3ccc(N4CCNCC4)cc3)c3nccn23)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK5 Q8IW41 13/20 0.60
▸ FYN P06241 1/20 0.58
▸ ADRB1 P08588 1/20 0.45
▸ PTK6 Q13882 2/20 0.43
▸ LCK P06239 1/20 0.43
▸ AURKB Q96GD4 1/20 0.43
▸ CDC7 O00311 1/20 0.42
▸ PIM1 P11309 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ TTK P33981 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL27359527 0.90 FYN (0.62) MAPKAPK5FYNPTK6PIM1TTK
SCHEMBL27254073 0.89 FYN (0.65) MAPKAPK5FYNADRB1PTK6MAPT
SCHEMBL27359536 0.84 MAPKAPK5 (0.54) MAPKAPK5FYNCDK9
SCHEMBL8246471 0.82 AURKA (0.62) MAPKAPK5FYNPTK6AURKB
SCHEMBL32666593 0.81 FYN (0.54) MAPKAPK5FYNADRB1PTK6LCK
SCHEMBL30806186 0.80 MAPKAPK5 (0.58) MAPKAPK5FYNCDK9MAPT
SCHEMBL27254182 0.79 MAPKAPK5 (0.70) MAPKAPK5FYN
SCHEMBL14536795 0.79 MAPKAPK5 (0.54) MAPKAPK5FYNPTK6AURKB
SCHEMBL4392693 0.77 MAPKAPK5 (0.68) MAPKAPK5FYNTTK
SCHEMBL2071019 0.76 MAPKAPK5 (0.80) MAPKAPK5FYNPTK6AURKB

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-2024026260-A1 SUBSTITUTED IMIDAZOPYRAZINE COMPOUNDS AS IRAK3 BINDERS CELGENE CORPORATION (US) 2024-02-01 — — WO disclosed
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