SCHEMBL5731691

SCHEMBL5731691

Cc1nc(N)c2nc(O)n(Cc3ccc(N)cc3)c2n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 15/20 0.43
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL5730974 0.92 TLR7 (0.43) TLR7ADORA2AADORA1KDM4EALDH1A1
SCHEMBL5731373 0.90 TLR7 (0.42) TLR7KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5730944 0.89 TLR7 (0.55) TLR7ADORA2AADORA1KDM4EALDH1A1
SCHEMBL8054143 0.89 L3MBTL1 (0.47) TLR7KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL5731860 0.88 TLR7 (0.43) TLR7ADORA2AADORA1
SCHEMBL5731978 0.87 KDM4E (0.47) TLR7KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5731748 0.87 CCR9 (0.42) TLR7ADORA2ASMN1; SMN2
SCHEMBL10309737 0.86 TLR7 (0.44) TLR7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5731513 0.84 L3MBTL1 (0.50) TLR7KDM4ESMN1; SMN2LMNA
SCHEMBL5731246 0.83 FBP1 (0.44) TLR7ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1043021-B1 PURINE DERIVATIVES FOR THE TREATMENT OF ALLERGIC DISEASES AND SYSTEMIC LUPUS ERYTHEMATOSUS DAINIPPON SUMITOMO PHARMA CO (JP) 2006-05-03 — — EP disclosed
EP-0882727-B9 NOVEL PURINE DERIVATIVES SUMITOMO PHARMA (JP) 2005-06-15 — — EP disclosed
EP-0882727-B1 NOVEL PURINE DERIVATIVES SUMITOMO PHARMA (JP) 2004-12-01 — — EP disclosed
US-6376501-B1 INHIBITING OR REGULATING IMMUNE RESPONSE USING PURINE-DERIVED COMPOUND; NON-STEROIDAL COMPOUND JAPAN ENERGY CORPORATION (JP) 2002-04-23 — — US disclosed
EP-1043021-A1 TYPE 2 HELPER T CELL-SELECTIVE IMMUNE RESPONSE SUPPRESSORS Japan Energy Corporation (JP) 2000-10-11 — — EP disclosed
EP-0882727-A1 NOVEL PURINE DERIVATIVES JAPAN ENERGY CORPORATION (JP) 1998-12-09 — — EP disclosed
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