SCHEMBL31351018

SCHEMBL31351018

CN(C)CCn1cc2cc(NC(=O)c3csc(-c4ccncc4)n3)c(-c3ccoc3)cc2n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 12/20 0.49
▸ IRAK1 P51617 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ CHEK1 O14757 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ CSNK1D P48730 2/20 0.39
▸ CSNK1E P49674 2/20 0.39
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ IDE P14735 1/20 0.36
▸ MAPK10 P53779 1/20 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
SCHEMBL31351088 0.92 IRAK4 (0.47) IRAK4IRAK1KCNH2CHEK1
SCHEMBL31351241 0.90 IRAK4 (0.46) IRAK4IRAK1KCNH2CHEK1
SCHEMBL31350975 0.89 IRAK4 (0.51) IRAK4IRAK1CHEK1HPGDLMNA
SCHEMBL31351243 0.89 IRAK4 (0.50) IRAK4IRAK1KCNH2CSNK1DCSNK1E
SCHEMBL31351142 0.88 IRAK4 (0.47) IRAK4CHEK1HPGDCSNK1DCSNK1E
SCHEMBL31350922 0.88 IRAK4 (0.47) IRAK4IRAK1KCNH2CHEK1HPGD
SCHEMBL31351117 0.86 IRAK4 (0.44) IRAK4CHEK1HPGDCSNK1DCSNK1E
SCHEMBL31351228 0.86 IRAK4 (0.44) IRAK4CHEK1LMNAMAPT
SCHEMBL31351056 0.84 IRAK4 (0.45) IRAK4IRAK1KCNH2CHEK1HPGD
SCHEMBL31351179 0.83 IRAK4 (0.49) IRAK4IRAK1CHEK1LMNA

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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