SCHEMBL29328886

SCHEMBL29328886

N#Cc1cc(OCc2cccc(N3CCOCC3)n2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.45
PIK3CA P42336 5/20 0.44
MAP3K8 P41279 1/20 0.39
PDE10A Q9Y233 4/20 0.39
CSF1R P07333 2/20 0.37
ABL1 P00519 1/20 0.36
BCR P11274 1/20 0.36
TYK2 P29597 1/20 0.36
SYK P43405 1/20 0.36
BRSK1 Q8TDC3 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
SMG1 Q96Q15 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
PDGFRB P09619 1/20 0.36
KIT P10721 1/20 0.36
FLT3 P36888 1/20 0.36
ATR Q13535 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
SCHEMBL29329871 0.81 RET (0.39) PRKCQSYK
SCHEMBL29330024 0.81 MAOB (0.37) PRKCQABL1BCRSYK
SCHEMBL29328592 0.78 SYK (0.45) PRKCQSYK
SCHEMBL29330430 0.78 PRKCQ (0.43) PRKCQABL1SYK
SCHEMBL24539134 0.78 JAK2 (0.44) PRKCQPIK3CASYKPDGFRB
SCHEMBL30629373 0.78 JAK2 (0.44) PRKCQPIK3CASYKPDGFRB
SCHEMBL29328808 0.78 PRKCQ (0.41) PRKCQSYK
SCHEMBL29329434 0.77 MAPT (0.43) PRKCQSYK
SCHEMBL29329292 0.76 SIRT2 (0.41) PRKCQSYK
SCHEMBL29330342 0.75 SYK (0.40) PRKCQABL1BCRSYK

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-2024151919-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2024-07-18 WO disclosed