SCHEMBL29638426

SCHEMBL29638426

COc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)ncn4)cc32)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.41
PRKDC P78527 4/20 0.40
PIK3CA P42336 3/20 0.40
MEN1 O00255 3/20 0.39
RAB9A P51151 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
EGFR P00533 6/20 0.38
ERBB3 P21860 5/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
CYP1A2 P05177 1/20 0.37
MTOR P42345 1/20 0.37
GABRA1 P14867 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRA6 Q16445 1/20 0.37
MAPT P10636 2/20 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
SCHEMBL24557285 1.00 PLK1 (0.41) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL24557278 0.90 MEN1 (0.39) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL29638413 0.90 MEN1 (0.39) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL29638404 0.88 TYK2 (0.40) PLK1PRKDCPIK3CAMEN1KMT2A
SCHEMBL24557308 0.88 TYK2 (0.40) PLK1PRKDCPIK3CAMEN1KMT2A
SCHEMBL24557289 0.87 LYN (0.42) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL29638395 0.87 LYN (0.42) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL24557271 0.86 SRC (0.46) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL24557279 0.86 MEN1 (0.42) PLK1PRKDCPIK3CAMEN1RAB9A
SCHEMBL29638478 0.86 MEN1 (0.42) PLK1PRKDCPIK3CAMEN1RAB9A

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-2022136914-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2022-06-30 WO disclosed