SCHEMBL7984759

SCHEMBL7984759

CC(C)(C)OC(=O)Nc1cccc(-c2nc3ncn(Cc4ccccc4)c3c(=O)[nH]2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
KMT2A Q03164 3/20 0.42
P2RX7 Q99572 1/20 0.42
TLR7 Q9NYK1 1/20 0.40
MAPT P10636 3/20 0.40
FAAH O00519 1/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 3/20 0.39
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
MMP8 P22894 2/20 0.39
CYP17A1 P05093 1/20 0.39
CDK9 P50750 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
NPY1R P25929 1/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 2/20 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
SCHEMBL7984479 0.91 HPGD (0.52) HPGDALDH1A1SMN1; SMN2KMT2AP2RX7
SCHEMBL7984762 0.87 P2RX7 (0.45) HPGDALDH1A1SMN1; SMN2KMT2AP2RX7
SCHEMBL7974542 0.84 SMN1; SMN2 (0.53) HPGDALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL7984761 0.83 CYP17A1 (0.42) HPGDP2RX7TLR7MAPTGAA
SCHEMBL7974152 0.82 HPGD (0.47) HPGDALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL7985332 0.79 SMN1; SMN2 (0.55) HPGDALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL7988590 0.79 ALDH1A1 (0.53) HPGDALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL7975265 0.78 SMN1; SMN2 (0.61) HPGDALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL7974583 0.78 GAA (0.59) HPGDALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL7984466 0.78 HPGD (0.42) HPGDALDH1A1SMN1; SMN2KMT2AGAA

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