SCHEMBL7988583

SCHEMBL7988583

Nc1cccc(-c2nc(O)c3c(ncn3CCc3ccccc3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
KMT2A Q03164 2/20 0.41
ADORA2A P29274 3/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADORA1 P30542 1/20 0.41
CNOT7 Q9UIV1 6/20 0.37
HTT P42858 1/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
GLA P06280 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
FAAH O00519 1/20 0.36
PIK3C2A O00443 1/20 0.36
ATAD2 Q6PL18 1/20 0.36
PKM P14618 1/20 0.35

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
SCHEMBL7986355 0.94 SIGMAR1 (0.42) ALDH1A1KDM4EMEN1LMNAMAPT
SCHEMBL7984659 0.90 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1LMNAMAPT
SCHEMBL7984406 0.89 CASR (0.43) ALDH1A1ADORA2AADORA3ADORA1CNOT7
Hydrochloric Acid SCHEMBL7987662 0.89 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1LMNAMAPT
SCHEMBL7974615 0.89 ADORA2A (0.44) ALDH1A1ADORA2AADORA3ADORA1CNOT7
SCHEMBL7988551 0.87 ADORA3 (0.43) ALDH1A1KDM4EHPGDADORA2AADORA3
SCHEMBL7984683 0.87 CNOT7 (0.37) ALDH1A1ADORA2AADORA3ADORA1CNOT7
SCHEMBL7989009 0.84 GAA (0.47) ALDH1A1KDM4EMEN1LMNAMAPT
SCHEMBL7992303 0.83 CNOT7 (0.40) KDM4ELMNAADORA2AADORA3ADORA1
SCHEMBL7991678 0.82 HTT (0.40) ALDH1A1KDM4EMEN1KMT2AADORA2A

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