SCHEMBL30445348

SCHEMBL30445348

CC(C)NC(=O)c1ncc(C(N)=O)cc1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 4/20 0.39
▸ MLYCD O95822 1/20 0.39
▸ DYRK1A Q13627 3/20 0.38
▸ VNN1 O95497 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ GRM5 P41594 1/20 0.36
▸ NNMT P40261 2/20 0.36
▸ FPR2 P25090 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ NPSR1 Q6W5P4 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
SCHEMBL26151627 0.77 MLYCD (0.39) MLYCDDYRK1AAURKANPC1RAB9A
SCHEMBL23732706 0.77 SMN1; SMN2 (0.44) MLYCDDYRK1AFPR2
SCHEMBL12350329 0.76 NNMT (0.40) HPGDSVNN1NNMT
SCHEMBL19105598 0.73 HPGDS (0.41) HPGDSVNN1NNMT
SCHEMBL30445879 0.73 PARP10 (0.44) HPGDSVNN1NNMT
SCHEMBL27316973 0.72 DYRK1A (0.42) MLYCDDYRK1AAURKAGRM5NPSR1
SCHEMBL30445175 0.71 TSHR (0.38) HPGDSVNN1NNMT
SCHEMBL26337535 0.71 LMNA (0.42) HPGDSVNN1NNMT
SCHEMBL13394495 0.70 NNMT (0.39) HPGDSNNMT
SCHEMBL30151852 0.70 NNMT (0.49) HPGDSNNMT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4405344-A2 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS Xenon Pharmaceuticals Inc. (CA) 2024-07-31 — — EP disclosed
WO-2023049369-A2 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-03-30 — — WO disclosed
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