SCHEMBL7987962

SCHEMBL7987962

CCc1nc(O)c2c(ncn2Cc2ccc(-c3ccccc3-n3ncnn3)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AGTR1 P30556 2/20 0.32
AGTR2 P50052 2/20 0.32
NR1H4 Q96RI1 2/20 0.31
HPGD P15428 1/20 0.31
GAA P10253 1/20 0.31
MET P08581 1/20 0.30

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
SCHEMBL7973934 0.81 CYP11B1 (0.45) ALDH1A1SMN1; SMN2HPGDGAAMET
SCHEMBL7987968 0.80 SMN1; SMN2 (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7975252 0.78 HPGD (0.45) ALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL7988129 0.76 MET (0.44) ALDH1A1SMN1; SMN2HPGDGAAMET
SCHEMBL7987434 0.75 CYP11B1 (0.42) ALDH1A1SMN1; SMN2HPGDMET
SCHEMBL7984526 0.74 MET (0.46) ALDH1A1SMN1; SMN2HPGDMET
SCHEMBL7985651 0.73 CYP1A2 (0.41) ALDH1A1SMN1; SMN2HPGDGAAMET
SCHEMBL8059823 0.72 MEN1 (0.45) ALDH1A1SMN1; SMN2AGTR1AGTR2NR1H4
SCHEMBL7984468 0.72 ABCC8 (0.46) ALDH1A1SMN1; SMN2NR1H4HPGDMET
SCHEMBL7987782 0.72 NPC1 (0.44) ALDH1A1SMN1; SMN2HPGDGAA

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