SCHEMBL7207412

SCHEMBL7207412

CN(Cc1ccccc1)c1nc(N)c2nc(O)n(Cc3ccccc3)c2n1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 8/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 2/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7205536 0.89 TLR7 (0.44) TLR7ADORA2AADORA1MAPTMAPK1
SCHEMBL7204601 0.86 ADORA2A (0.60) TLR7ADORA2AADORA1LMNAMAPT
SCHEMBL5730944 0.80 TLR7 (0.55) TLR7ADORA2AADORA1MAPK1ALDH1A1
SCHEMBL7204709 0.79 ADORA2A (0.47) TLR7ADORA2AADORA1MAPK1ALDH1A1
SCHEMBL7212493 0.79 ADORA2A (0.47) TLR7ADORA2AADORA1MAPK1
SCHEMBL2060321 0.78 ADORA2A (0.46) TLR7ADORA2AADORA1MAPTMAPK1
SCHEMBL14944613 0.78 ADORA2A (0.46) TLR7ADORA2AADORA1MAPK1
SCHEMBL10174942 0.78 TLR7 (0.49) TLR7ADORA2AADORA1ALDH1A1HPGD
SCHEMBL7209948 0.78 TSHR (0.52) TLR7ADORA2AADORA1LMNAMAPT
SCHEMBL19370095 0.77 ADORA2A (0.45) TLR7ADORA2AADORA1MAPK1

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