SCHEMBL7974406

SCHEMBL7974406

CCOc1cccc(-c2nc(O)c3c(ncn3Cc3ccccc3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
ICMT O60725 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
ALDH1A1 P00352 2/20 0.39
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
PGGT1B P53609 2/20 0.38
FGFR1 P11362 2/20 0.38
FGFR2 P21802 1/20 0.38
FGFR3 P22607 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 1/20 0.37
SLC16A3 O15427 1/20 0.37
SLC16A1 P53985 1/20 0.37
MCTS1 Q9ULC4 1/20 0.37

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
SCHEMBL7985395 0.91 GAA (0.43) GAANR1H2NR1H3HPGDSMN1; SMN2
SCHEMBL7974584 0.91 GAA (0.56) GAANR1H2NR1H3ALDH1A1TP53
SCHEMBL7984454 0.89 GAA (0.42) GAA
SCHEMBL7974478 0.88 LMNA (0.43) GAAALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL7985850 0.85 GAA (0.49) GAANR1H2NR1H3TP53
SCHEMBL7988594 0.85 TP53 (0.44) GAAICMTALDH1A1HPGDSMN1; SMN2
SCHEMBL7985336 0.85 PIK3CA (0.42) GAAALDH1A1HPGDSMN1; SMN2
SCHEMBL7974018 0.84 GAA (0.53) GAANR1H2NR1H3ALDH1A1TP53
SCHEMBL7975267 0.84 SMN1; SMN2 (0.46) GAANR1H3ALDH1A1HPGDSMN1; SMN2
SCHEMBL7985348 0.84 GAA (0.53) GAANR1H2NR1H3ALDH1A1HPGD

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