SCHEMBL27604149

SCHEMBL27604149

CN1CCN([CH]CCc2nn(COCC[Si](C)(C)C)c3cc(Cl)c(-c4ccccc4)cc23)CC1

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KLK7 P49862 1/20 0.32
PRKAB2 O43741 2/20 0.32
PRKAG1 P54619 2/20 0.32
PRKAA2 P54646 2/20 0.32
PRKAA1 Q13131 2/20 0.32
PRKAG3 Q9UGI9 2/20 0.32
PRKAG2 Q9UGJ0 2/20 0.32
PRKAB1 Q9Y478 2/20 0.32
EGFR P00533 1/20 0.30
IGF1R P08069 1/20 0.30
SRC P12931 1/20 0.30
FLT4 P35916 1/20 0.30
KDR P35968 1/20 0.30
FLT3 P36888 1/20 0.30
EPHB4 P54760 1/20 0.30
TEK Q02763 1/20 0.30

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
SCHEMBL1234876 0.77 SCN9A (0.36) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL6207856 0.73 KDM4E (0.42) KDM4EPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL27604126 0.71 PRKAB2 (0.48) KDM4EALDH1A1KLK7PRKAB2PRKAG1
SCHEMBL4496683 0.71 ACP1 (0.35) KDM4EALDH1A1
SCHEMBL1234014 0.70 GSK3B (0.52) KDM4E
SCHEMBL4488611 0.70 GSK3B (0.48) FLT4KDRFLT3
SCHEMBL3519003 0.65 CNR2 (0.42) KDM4EALDH1A1
SCHEMBL14158232 0.64 NPC1 (0.43) KDM4EALDH1A1EGFRIGF1RSRC
SCHEMBL19950721 0.63 ALK (0.44) SRCKDRFLT3
SCHEMBL6486769 0.63 GSK3B (0.60) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1982316-A Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2007-06-20 CN disclosed
CN-1678589-A Novel aminoindazole derivatives as medicaments and pharmaceutical compositions containing them AVENTIS PHARMA SA (FR) 2005-10-05 CN disclosed