SCHEMBL7985335

SCHEMBL7985335

CCCCCCn1cnc(N)c1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ADORA2A P29274 1/20 0.42
KMT2A Q03164 1/20 0.41
ICMT O60725 1/20 0.39
AMPD1 P23109 2/20 0.38
ADCY5 O95622 1/20 0.38
AMPD2 Q01433 1/20 0.38
KDR P35968 4/20 0.38

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
Hydrochloric Acid SCHEMBL7974102 0.98 TLR8 (0.46) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL7988227 0.98 TLR8 (0.45) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL7974495 0.94 ADORA2A (0.48) TLR8ALDH1A1TDP1ADORA2AKMT2A
Hydrochloric Acid SCHEMBL7984737 0.92 ADORA2A (0.47) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL7985623 0.87 ADORA2A (0.45) ADORA2A
SCHEMBL18050894 0.85 TLR8 (0.41) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL18050888 0.83 TLR8 (0.42) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL7988189 0.80 ADORA2A (0.42) ALDH1A1ADORA2A
SCHEMBL28819811 0.77 TLR8 (0.51) TLR8ALDH1A1TDP1ADORA2AKMT2A
SCHEMBL7992360 0.75 ADRA1D (0.46) ADORA2AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed