SCHEMBL31350911

SCHEMBL31350911

CN(C)CCn1ncc2cc(NC(=O)c3csc(-c4ccncc4)n3)c(-c3ccsc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 9/20 0.41
▸ HPGD P15428 1/20 0.40
▸ CHEK1 O14757 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ IDE P14735 1/20 0.37
▸ MAPK10 P53779 1/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ CSNK1D P48730 1/20 0.36
▸ CSNK1E P49674 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
SCHEMBL31351092 0.93 IRAK4 (0.49) IRAK4CHEK1MAPK1NPC1RAB9A
SCHEMBL31351116 0.90 IRAK4 (0.42) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351121 0.90 IRAK4 (0.42) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351300 0.88 IRAK4 (0.40) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351033 0.83 IRAK4 (0.50) IRAK4CHEK1MAPK1NPC1RAB9A
SCHEMBL31350922 0.82 IRAK4 (0.47) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351062 0.77 CHEK1 (0.42) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351066 0.77 IRAK4 (0.54) IRAK4CHEK1MAPK1NPC1RAB9A
SCHEMBL31351101 0.75 IRAK4 (0.41) IRAK4HPGDCHEK1LMNAMAPT
SCHEMBL31351306 0.72 HTR1D (0.44) NPC1RAB9APOLB

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
Send feedback