SCHEMBL9099767

SCHEMBL9099767

Nc1ncc(Sc2ccc3cc(F)ccc3n2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.46
GFER P55789 2/20 0.41
AXL P30530 1/20 0.41
APP P05067 3/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
MYC P01106 1/20 0.36
WDR5 P61964 1/20 0.36
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PI4KA P42356 1/20 0.33
PIK3CG P48736 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
ILK Q13418 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 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
SCHEMBL9097754 0.84 BACE1 (0.46) BACE1GFERAPPMYCWDR5
SCHEMBL9098317 0.83 MYC (0.35) BACE1MYCWDR5PIK3CDPIK3CA
SCHEMBL9097135 0.80 NCF1 (0.41) BACE1MYCWDR5KDM4EMEN1
SCHEMBL9426725 0.73 MYC (0.40) GFERAXLMYCWDR5ALDH1A1
SCHEMBL9099215 0.70 HPGD (0.54) MYCWDR5KDM4EALDH1A1LMNA
SCHEMBL9099400 0.69 MYC (0.37) MYCWDR5KDM4EMEN1ALDH1A1
SCHEMBL9099459 0.68 BACE1 (0.44) BACE1GFERAXLAPPPDGFRB
SCHEMBL9097968 0.68 ADORA3 (0.46) BACE1GFERAXLAPPPDGFRB
SCHEMBL9098198 0.68 MYC (0.59) BACE1MYCWDR5ALDH1A1MAPT
SCHEMBL27200601 0.67 MAPT (0.49) BACE1APPKDM4EMEN1ALDH1A1

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-1996030370-A2 THIAZOLE AND THIADIAZOLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS USEFUL IN THE TREATMENT OF THROMBOCYTOPENIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-03 WO disclosed