SCHEMBL9099459

SCHEMBL9099459

Nc1ncc([S+]([O-])c2ccc3cc(F)ccc3n2)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.44
GFER P55789 2/20 0.39
AXL P30530 1/20 0.39
APP P05067 2/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
PI4KA P42356 1/20 0.32
PIK3CG P48736 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
ILK Q13418 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX12 P18054 1/20 0.31

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
SCHEMBL9099556 0.85 BACE1 (0.44) BACE1GFERAPPPIK3CAPIK3CD
SCHEMBL9097546 0.81 NCF1 (0.39) BACE1KDM4EMEN1ALDH1A1MAPT
SCHEMBL9426724 0.74 ALDH1A1 (0.34) GFERAXLALDH1A1LMNA
SCHEMBL9098537 0.71 ALDH1A1 (0.35) PDGFRBPDGFRAKDM4EALDH1A1LMNA
SCHEMBL9097235 0.71 KDM4E (0.37) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL9099497 0.70 NOS1 (0.44) BACE1ALDH1A1MAPTTDP1
SCHEMBL9099767 0.68 BACE1 (0.46) BACE1GFERAXLAPPPDGFRB
SCHEMBL9049092 0.68 KMT2A (0.36) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL9097968 0.67 ADORA3 (0.46) BACE1GFERAXLAPPPDGFRB
SCHEMBL8940793 0.66 NOS1 (0.34) PIK3CAPIK3CDPI4KAPIK3CGPI4KB

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