SCHEMBL9753480

SCHEMBL9753480

CCOC(=O)c1c(C(C)C)nn2c(Br)cc(Br)c2c1-c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.42
MAPT P10636 3/20 0.42
DGAT1 O75907 1/20 0.41
SOAT1 P35610 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHRNA7 P36544 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
SLC10A2 Q12908 1/20 0.38
KDM4E B2RXH2 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.38
GPR55 Q9Y2T6 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRM6 O15303 1/20 0.38

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
SCHEMBL9752966 0.84 DGAT1 (0.41) MAPTDGAT1SOAT1ALDH1A1L3MBTL1
SCHEMBL9753077 0.84 ALDH1A1 (0.44) GCGRMAPTDGAT1SOAT1ALDH1A1
SCHEMBL5089841 0.84 GCGR (0.43) GCGRMAPTHTTALDH1A1L3MBTL1
SCHEMBL3820745 0.79 MAPT (0.47) GCGRMAPTHTTALDH1A1L3MBTL1
SCHEMBL3822819 0.78 GCGR (0.43) GCGRMAPTHTTALDH1A1L3MBTL1
SCHEMBL9753340 0.78 GCGR (0.43) GCGRMAPTALDH1A1L3MBTL1NPSR1
SCHEMBL5089700 0.77 GCGR (0.38) GCGRMAPTDGAT1SOAT1ALDH1A1
SCHEMBL5094505 0.77 GCGR (0.47) GCGRMAPTDGAT1SOAT1ALDH1A1
SCHEMBL5095559 0.77 GCGR (0.43) GCGRMAPTHTTALDH1A1L3MBTL1
SCHEMBL2648212 0.77 GCGR (0.62) GCGRMAPTHTTALDH1A1L3MBTL1

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
WO-1991018903-A1 PYRROLOPYRIDAZINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-12 WO disclosed