SCHEMBL28499045

SCHEMBL28499045

CS(=O)(=O)Nc1ncc(Cl)cn1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.44
KIF11 P52732 1/20 0.42
PIK3CB P42338 3/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CA P42336 2/20 0.41
PIK3CG P48736 2/20 0.41
MET P08581 1/20 0.40
PTGS1 P23219 5/20 0.39
PTGS2 P35354 5/20 0.39
GLO1 Q04760 1/20 0.39
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KEAP1 Q14145 1/20 0.35
MAPK1 P28482 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
SCHEMBL25680865 0.80 PTGS1 (0.38) PIK3CBPIK3CDPIK3CAPIK3CGPTGS1
SCHEMBL18555412 0.78 EDNRA (0.44) EDNRAPIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL28493309 0.78 PTGS1 (0.39) PIK3CBPIK3CDPIK3CAPIK3CGPTGS1
SCHEMBL28493518 0.75 LMNA (0.57) PIK3CBPIK3CDPIK3CAPIK3CGPTGS1
SCHEMBL12256025 0.75 GLO1 (0.48) EDNRAMETGLO1KDM4EKMT2A
SCHEMBL12018120 0.74 KDM4E (0.60) EDNRAPOLBKDM4EMEN1KMT2A
SCHEMBL14799076 0.74 P4HTM (0.46) KDM4EKMT2A
SCHEMBL19650821 0.74 PTK2 (0.42) PIK3CBPIK3CDPIK3CAPIK3CGPTGS1
SCHEMBL29955903 0.74 ENPP2 (0.38) PIK3CBPIK3CDPIK3CAPIK3CGGLO1
SCHEMBL9949119 0.73 KEAP1 (0.38) PIK3CBPIK3CDPIK3CAPIK3CGGLO1

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-112055713-A Compounds and compositions for treating diseases associated with APJ receptor activity 安娜普尔纳生物股份有限公司 2020-12-08 CN disclosed