SCHEMBL31350922

SCHEMBL31350922

CN(C)CCn1cc2cc(NC(=O)c3csc(-c4ccncc4)n3)c(-c3ccsc3)cc2n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 12/20 0.47
▸ IRAK1 P51617 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ HPGD P15428 1/20 0.40
▸ CHEK1 O14757 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ CSNK1E P49674 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAPK1 P28482 2/20 0.38
▸ IDE P14735 1/20 0.37
▸ MAPK10 P53779 1/20 0.37

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
SCHEMBL31351066 0.92 IRAK4 (0.54) IRAK4IRAK1KCNH2CHEK1MAPK1
SCHEMBL31351018 0.88 IRAK4 (0.49) IRAK4IRAK1KCNH2HPGDCHEK1
SCHEMBL31350809 0.87 IRAK4 (0.48) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351056 0.85 IRAK4 (0.45) IRAK4IRAK1KCNH2HPGDCHEK1
SCHEMBL31350999 0.85 IRAK4 (0.45) IRAK4CHEK1LMNAMAPT
SCHEMBL31351246 0.85 IRAK4 (0.46) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31350911 0.82 IRAK4 (0.41) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351174 0.82 IRAK4 (0.51) IRAK4IRAK1HPGDCHEK1
SCHEMBL31351132 0.82 IRAK4 (0.54) IRAK4IRAK1CHEK1MAPK1
SCHEMBL31351231 0.81 IRAK4 (0.50) IRAK4IRAK1CHEK1LMNACSNK1D

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-2025003987-A1 NOVEL CARBOXAMIDE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 동화약품주식회사 2025-01-02 — — WO disclosed
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