SCHEMBL29860412

SCHEMBL29860412

CCc1cccc(Nc2nc(Cl)ncc2Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SYK P43405 5/20 0.47
IGF1R P08069 2/20 0.46
EGFR P00533 2/20 0.45
GRM4 Q14833 1/20 0.45
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
RAPGEF4 Q8WZA2 1/20 0.43
CDK1 P06493 1/20 0.42
ABL1 P00519 1/20 0.41
PDGFRB P09619 1/20 0.41
SRC P12931 1/20 0.41
PDGFRA P16234 1/20 0.41
MAPK14 Q16539 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL27047622 1.00 MEN1 (0.56) MEN1KMT2ASYKIGF1REGFR
SCHEMBL14368042 0.85 RAPGEF4 (0.50) SYKEGFRGRM4CDK5CDK5R1
SCHEMBL9945496 0.82 EGFR (0.61) MEN1KMT2ASYKIGF1REGFR
SCHEMBL1024631 0.82 BTK (0.44) MEN1KMT2ASYKIGF1REGFR
SCHEMBL2386416 0.82 SYK (0.70) SYK
SCHEMBL4175837 0.81 SYK (0.51) MEN1KMT2ASYKIGF1REGFR
SCHEMBL655633 0.80 SYK (0.72) MEN1KMT2ASYKIGF1REGFR
SCHEMBL1774193 0.78 IGF1R (0.68) MEN1KMT2ASYKIGF1REGFR
SCHEMBL15994648 0.78 BTK (0.49) MEN1KMT2ASYKIGF1REGFR
SCHEMBL13622715 0.77 SYK (0.48) MEN1KMT2ASYKIGF1REGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115348963-B Pyridopyrimidine compound and application thereof 暨南大学 2024-04-19 CN disclosed
EP-4310084-A1 PYRIDOPYRIMIDINE-BASED COMPOUND AND APPLICATION THEREOF Jinan University (CN) 2024-01-24 EP disclosed
CN-115348963-A Pyridopyrimidine compound and application thereof 暨南大学 2022-11-15 CN disclosed
WO-2022188755-A1 PYRIDOPYRIMIDINE-BASED COMPOUND AND APPLICATION THEREOF 暨南大学 2022-09-15 WO disclosed