SCHEMBL30739437

SCHEMBL30739437

COc1ccc(CNc2ncnc3c(C)c(-c4ncc(N)cc4OC)n(-c4ccc(O)c(F)c4)c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.40
MAPT P10636 5/20 0.38
KDM4E B2RXH2 3/20 0.38
POLB P06746 2/20 0.38
BLM P54132 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
AURKA O14965 2/20 0.37
RPS6KB1 P23443 2/20 0.37
EGFR P00533 1/20 0.35
NR2F2 P24468 1/20 0.35
CHRM4 P08173 2/20 0.35
CCNB2 O95067 3/20 0.35
CDK1 P06493 3/20 0.35
CCNB1 P14635 3/20 0.35
CCNB3 Q8WWL7 3/20 0.35
FYN P06241 2/20 0.34

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
SCHEMBL29178929 1.00 PDE5A (0.40) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL29178811 0.95 MAPT (0.40) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL30739214 0.95 MAPT (0.40) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL30739299 0.93 MAPT (0.40) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL29178637 0.93 MAPT (0.40) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL29178730 0.91 PDE5A (0.39) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL30739335 0.91 PDE5A (0.39) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL30739251 0.88 MAPT (0.39) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL29178723 0.88 MAPT (0.39) PDE5AMAPTKDM4EPOLBBLM
SCHEMBL29178729 0.87 PDE5A (0.39) PDE5AMAPTKDM4EPOLBBLM

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
CN-117466897-A Highly selective FGFR2 inhibitors 深圳福沃药业有限公司 2024-01-30 CN disclosed