SCHEMBL7985232

SCHEMBL7985232

Cc1cccc(Cn2cnc3nc(-c4ccc(N)cc4)[nH]c(=O)c32)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.44
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TNKS O95271 4/20 0.43
PARP1 P09874 4/20 0.43
TNKS2 Q9H2K2 4/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
HTT P42858 2/20 0.41
TSHR P16473 2/20 0.41
MAPK14 Q16539 1/20 0.40
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ALOX15 P16050 1/20 0.39
MMP13 P45452 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
SCHEMBL7974266 0.92 ALDH1A1 (0.50) HPGDALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL7991556 0.91 HPGD (0.43) HPGDALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL7988564 0.91 HPGD (0.47) HPGDALDH1A1SMN1; SMN2TNKSTNKS2
SCHEMBL7988745 0.90 HPGD (0.44) HPGDALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL7985058 0.87 HPGD (0.44) HPGDALDH1A1SMN1; SMN2TNKSPARP1
SCHEMBL7975129 0.87 SMN1; SMN2 (0.56) HPGDALDH1A1SMN1; SMN2TNKSPARP1
Hydrochloric Acid SCHEMBL7985511 0.86 SMN1; SMN2 (0.55) HPGDALDH1A1SMN1; SMN2TNKSPARP1
SCHEMBL7988952 0.86 GRIN1 (0.43) HPGDALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL7975238 0.86 HPGD (0.45) HPGDALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL7974245 0.86 HPGD (0.45) HPGDALDH1A1SMN1; SMN2KMT2ALMNA

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