SCHEMBL7984968

SCHEMBL7984968

COCOc1c(C)cc(-c2nc(O)c3c(ncn3Cc3ccccc3)n2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
P2RX7 Q99572 3/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
ALDH1A1 P00352 2/20 0.36
TLR7 Q9NYK1 1/20 0.35
LMNA P02545 1/20 0.34
BRD4 O60885 4/20 0.34
KMT2A Q03164 2/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
ADORA2B P29275 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL7988683 0.87 GAA (0.38) GAAP2RX7HPGDSMN1; SMN2ALDH1A1
SCHEMBL7984888 0.86 HPGD (0.41) GAAHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL7985325 0.84 HPGD (0.42) GAAHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL7985348 0.82 GAA (0.53) GAAP2RX7HPGDSMN1; SMN2ALDH1A1
SCHEMBL7988787 0.81 SMN1; SMN2 (0.42) GAAHPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL7975267 0.80 SMN1; SMN2 (0.46) GAAHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL7988602 0.79 GAA (0.45) GAAP2RX7TLR7LMNAKMT2A
SCHEMBL7988594 0.79 TP53 (0.44) GAAHPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL7985225 0.79 GAA (0.48) GAAP2RX7HPGDSMN1; SMN2ALDH1A1
SCHEMBL7985284 0.78 TLR4 (0.35) GAAHPGDALDH1A1TLR7LMNA

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