SCHEMBL29949172

SCHEMBL29949172

Cc1cnc(NCc2cccc(N)c2N)o1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.34
ELANE P08246 1/20 0.34
MAPT P10636 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
EGFR P00533 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BTK Q06187 1/20 0.32
MAP4K4 O95819 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL26965537 1.00 CD44 (0.34) CD44ELANEMAPTNPC1RAB9A
SCHEMBL29949182 0.79 HDAC4 (0.46) CD44ELANEMAPTNPC1RAB9A
SCHEMBL26965595 0.79 HDAC4 (0.46) CD44ELANEMAPTNPC1RAB9A
SCHEMBL26965586 0.75 EGFR (0.32) EGFRMEN1KMT2A
SCHEMBL29949337 0.75 EGFR (0.32) EGFRMEN1KMT2A
SCHEMBL26965554 0.67 BACE1 (0.35) MAPTNPSR1HSD17B10MEN1LMNA
SCHEMBL29949208 0.67 BACE1 (0.35) MAPTNPSR1HSD17B10MEN1LMNA
SCHEMBL2993419 0.66 MAOA (0.45) MAPTNPSR1HSD17B10MEN1LMNA
SCHEMBL25143371 0.64 NPC1 (0.53) MAPTNPC1RAB9AHSD17B10LMNA
SCHEMBL9687484 0.64 MAPT (0.44) CD44MAPTNPC1NPSR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117561247-A Novel potassium channel inhibitors 阿塞西翁制药公司 2024-02-13 CN disclosed
EP-4313973-A1 NOVEL POTASSIUM CHANNEL INHIBITORS Acesion Pharma ApS (DK) 2024-02-07 EP disclosed
WO-2022200162-A1 NOVEL POTASSIUM CHANNEL INHIBITORS ACECION PHARMA APS (DK) 2022-09-29 WO disclosed