SCHEMBL4877536

SCHEMBL4877536

Cc1nc(N)c2ncn(CCCS(=O)(=O)Nc3ccc(Cl)cc3Cl)c2c1C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.39
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
BRAF P15056 8/20 0.34
KCNH2 Q12809 1/20 0.34
HTT P42858 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
SLC40A1 Q9NP59 1/20 0.33
GAA P10253 1/20 0.33
PDE8A O60658 1/20 0.33
HSP90B1 P14625 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4876618 0.97 YTHDC1 (0.38) YTHDC1POLBL3MBTL1BRAFKCNH2
SCHEMBL4794291 0.84 HSP90B1 (0.37) YTHDC1POLBL3MBTL1HTTSLC40A1
SCHEMBL4865127 0.83 MGAT2 (0.39) BRAFKCNH2
SCHEMBL4876728 0.82 TLR7 (0.40) L3MBTL1BRAFPIK3CDPIK3CAPIK3CB
SCHEMBL5340121 0.81 HSP90B1 (0.37) YTHDC1POLBL3MBTL1HTTSLC40A1
SCHEMBL4883115 0.80 TLR7 (0.38)
SCHEMBL4791328 0.80 HSP90B1 (0.36) YTHDC1POLBL3MBTL1HTTSLC40A1
SCHEMBL4868653 0.80 TLR7 (0.43)
SCHEMBL4879324 0.78 TLR7 (0.35) KCNH2SLC40A1HSP90B1
SCHEMBL4873557 0.77 TLR7 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 WO disclosed