SCHEMBL7974521

SCHEMBL7974521

COc1ccc(Cc2nc(=O)c3c(ncn3Cc3ccccc3)[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.48
PARN O95453 1/20 0.47
CNOT7 Q9UIV1 1/20 0.47
P2RX7 Q99572 5/20 0.46
HPGD P15428 3/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CTSL P07711 2/20 0.42
TYMP P19971 1/20 0.42
LTA4H P09960 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2B Q13224 1/20 0.41

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
SCHEMBL7985707 0.84 CYP11B2 (0.47) ADORA3PARNCNOT7P2RX7HPGD
SCHEMBL7985228 0.84 CXCR2 (0.50) PARNCNOT7P2RX7HPGDGAA
SCHEMBL7985346 0.83 CNOT7 (0.52) PARNCNOT7P2RX7HPGDGAA
SCHEMBL7974513 0.83 ADORA3 (0.53) ADORA3P2RX7HPGDGAAKDM4E
SCHEMBL7987785 0.82 PARN (0.47) PARNCNOT7HPGDKDM4EALDH1A1
SCHEMBL7984366 0.82 CNOT7 (0.53) PARNCNOT7HPGDALDH1A1
SCHEMBL7975254 0.82 CNOT7 (0.55) PARNCNOT7HPGDALDH1A1
Hydrochloric Acid SCHEMBL7992068 0.81 CNOT7 (0.52) PARNCNOT7HPGDALDH1A1
SCHEMBL7985687 0.81 CNOT7 (0.55) PARNCNOT7HPGDKDM4EALDH1A1
SCHEMBL7987705 0.80 CNOT7 (0.51) PARNCNOT7HPGDALDH1A1

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