SCHEMBL28443259

SCHEMBL28443259

CNCCOc1cn[c]c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.45
CHRNA4 P43681 1/20 0.45
HTR1B P28222 2/20 0.44
HTR1D P28221 1/20 0.44
CDC7 O00311 1/20 0.37
ROCK2 O75116 1/20 0.37
MAP4K4 O95819 1/20 0.37
PIM1 P11309 1/20 0.37
PRKACA P17612 1/20 0.37
CDK2 P24941 1/20 0.37
GSK3B P49841 1/20 0.37
HIPK2 Q9H2X6 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
PDK2 Q15119 1/20 0.35
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33

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
SCHEMBL18114209 0.81 SYK (0.36) CHRNB2CHRNA4
SCHEMBL18114249 0.79 ALDH1A1 (0.38) ALDH1A1PDK2
SCHEMBL2178430 0.79 NQO1 (0.38) CHRNB2CHRNA4KDM4EALDH1A1
SCHEMBL21795752 0.78 MAPT (0.43) KDM4ELMNA
SCHEMBL21795744 0.78 CHRNB2 (0.39) CHRNB2CHRNA4
SCHEMBL18114281 0.77
SCHEMBL28783617 0.75
SCHEMBL1022718 0.72
SCHEMBL18114202 0.72 CYP11B1 (0.31)
SCHEMBL18114246 0.71 MEN1 (0.34) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111747952-A Imidazoquinolinones and their use as ATM kinase inhibitors 默克专利股份公司 2020-10-09 CN claimed
CN-111689963-A Imidazoquinolinones and their use as ATM kinase inhibitors 默克专利股份公司 2020-09-22 CN claimed
CN-114615995-A Combined inhibition of PD-1, TGF beta and ATM and radiotherapy for cancer treatment 阿雷斯贸易股份有限公司 2022-06-10 CN disclosed
CN-111747952-A Imidazoquinolinones and their use as ATM kinase inhibitors 默克专利股份公司 2020-10-09 CN disclosed
CN-111689963-A Imidazoquinolinones and their use as ATM kinase inhibitors 默克专利股份公司 2020-09-22 CN disclosed
CN-107889488-B Imidazoquinolinones and their use as ATM kinase inhibitors 默克专利股份公司 2020-08-11 CN disclosed