SCHEMBL7984696

SCHEMBL7984696

COc1cccc(Cn2cnc3nc(-c4cccc(O)c4)nc(O)c32)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
TP53 P04637 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ABCG2 Q9UNQ0 2/20 0.45
CD74 P04233 1/20 0.42
MIF P14174 1/20 0.42
YTHDC1 Q96MU7 1/20 0.42
LPO P22079 2/20 0.41
ROCK2 O75116 5/20 0.41
ROCK1 Q13464 3/20 0.41
PTGER4 P35408 1/20 0.40
PTGER2 P43116 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
QPCT Q16769 2/20 0.39
QPCTL Q9NXS2 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 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
SCHEMBL7985850 0.95 GAA (0.49) GAATP53RXFP1ABCG2CD74
SCHEMBL7974018 0.92 GAA (0.53) GAATP53RXFP1ABCG2CD74
SCHEMBL7985653 0.91 GAA (0.46) GAATP53RXFP1ABCG2CD74
SCHEMBL7974093 0.90 GAA (0.48) GAATP53RXFP1ABCG2YTHDC1
SCHEMBL7974314 0.90 GAA (0.46) GAATP53RXFP1ABCG2YTHDC1
SCHEMBL7974584 0.90 GAA (0.56) GAATP53RXFP1ABCG2YTHDC1
SCHEMBL7985378 0.89 TSHR (0.47) GAATP53RXFP1ABCG2YTHDC1
SCHEMBL7991874 0.88 GAA (0.48) GAATP53RXFP1ABCG2YTHDC1
SCHEMBL7985577 0.88 ABCG2 (0.46) GAATP53RXFP1ABCG2NR1H2
SCHEMBL7989313 0.88 ROCK2 (0.52) GAATP53RXFP1YTHDC1LPO

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