SCHEMBL7210587

SCHEMBL7210587

CCOCCCSc1nc(N)c2nc(O)n(Cc3ccccc3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.44
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.39

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
SCHEMBL7205381 0.94 TLR7 (0.43) TLR7KDM4EALDH1A1GAAHPGD
SCHEMBL7206075 0.92 TLR7 (0.42) TLR7KDM4EALDH1A1GAAHPGD
SCHEMBL7205545 0.89 TLR7 (0.47) TLR7
SCHEMBL7204088 0.88 TLR7 (0.47) TLR7
SCHEMBL7211816 0.86 TLR7 (0.44) TLR7KDM4EALDH1A1GAAHPGD
SCHEMBL7208552 0.85 TLR7 (0.49) TLR7KDM4EALDH1A1GAAHPGD
SCHEMBL7205405 0.85 MAPK1 (0.48) TLR7TSHRMAPK1
SCHEMBL2060499 0.85 KDM4E (0.47) TLR7KDM4EALDH1A1GAAHPGD
SCHEMBL7208584 0.84 MAPK1 (0.47) TLR7TSHRMAPK1
SCHEMBL7209468 0.84 TLR7 (0.48) TLR7KDM4EALDH1A1GAAHPGD

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-1035123-B1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMA (JP) 2003-08-20 EP disclosed
US-6329381-B1 INTERFERONS, VIRICIDES AND ANTICARCINOGENIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-12-11 US disclosed
EP-1035123-A1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-09-13 EP disclosed