SCHEMBL24557271

SCHEMBL24557271

COc1ccc(Nc2cc3c(cn2)c(=O)[nH]n3-c2cccc(OC)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.46
LYN P07948 2/20 0.46
BTK Q06187 2/20 0.46
PRKDC P78527 5/20 0.42
PIK3CA P42336 4/20 0.42
GABRA1 P14867 3/20 0.41
GABRG2 P18507 3/20 0.41
GABRB3 P28472 3/20 0.41
GABRA5 P31644 3/20 0.41
GABRA3 P34903 3/20 0.41
GABRA2 P47869 2/20 0.41
GABRA6 Q16445 2/20 0.41
PLK1 P53350 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.40
MTOR P42345 2/20 0.39
TYK2 P29597 2/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL29638496 1.00 SRC (0.46) SRCLYNBTKPRKDCPIK3CA
SCHEMBL24557272 0.91 BTK (0.45) SRCLYNBTKPRKDCPIK3CA
SCHEMBL29638480 0.91 BTK (0.45) SRCLYNBTKPRKDCPIK3CA
SCHEMBL29638556 0.89 POLB (0.42) SRCLYNBTKPRKDCPIK3CA
SCHEMBL24557282 0.89 POLB (0.42) SRCLYNBTKPRKDCPIK3CA
SCHEMBL24557279 0.89 MEN1 (0.42) SRCLYNBTKPRKDCPIK3CA
SCHEMBL29638478 0.89 MEN1 (0.42) SRCLYNBTKPRKDCPIK3CA
SCHEMBL24557276 0.88 IDH1 (0.44) SRCLYNBTKPRKDCPIK3CA
SCHEMBL24557280 0.88 TNNI3K (0.39) SRCLYNBTKPRKDCPIK3CA
SCHEMBL29638334 0.88 IDH1 (0.44) SRCLYNBTKPRKDCPIK3CA

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