SCHEMBL4637478

SCHEMBL4637478

COc1cccnc1-c1c[c][nH]n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 2/20 0.37
PLAU P00749 1/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
PDE5A O76074 2/20 0.35
AURKA O14965 1/20 0.35
ITK Q08881 1/20 0.34
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
METAP2 P50579 2/20 0.33
KDM4E B2RXH2 2/20 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
SCHEMBL3632419 0.79 METAP2 (0.54) PLAUMETAP2KDM4ENPC1RAB9A
SCHEMBL3632883 0.76 CDC25B (0.36) ITKMETAP2
SCHEMBL3629372 0.76 METAP2 (0.33) METAP2
SCHEMBL3627348 0.76 GABRG2 (0.38) CBFBMETAP2NPC1
SCHEMBL3623263 0.76 DPP4 (0.35) METAP2
SCHEMBL5702570 0.75 CA1 (0.50) CBFBPLAUPDGFRBPDGFRAPDE5A
SCHEMBL29894839 0.75 CA1 (0.50) CBFBPLAUPDGFRBPDGFRAPDE5A
SCHEMBL7037994 0.73 SMN1; SMN2 (0.51) CBFBSMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL30867783 0.73 SMN1; SMN2 (0.51) CBFBSMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL20801654 0.71 CBFB (0.39) CBFBPLAUPDGFRBPDGFRAPDE5A

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
EP-1937664-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2008-07-02 EP disclosed
WO-2007043677-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-19 WO disclosed