SCHEMBL7985245

SCHEMBL7985245

CCc1nc(O)c2c(ncn2Cc2cc(OC)c(OC)c(OC)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.44
HSP90AB1 P08238 1/20 0.44
TLR7 Q9NYK1 9/20 0.40
PTGS2 P35354 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TLR8 Q9NR97 2/20 0.35
POLB P06746 1/20 0.35
DHFR P00374 1/20 0.35
SLC2A1 P11166 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
SCHEMBL7987469 0.87 TLR7 (0.44) TLR7MEN1KMT2ATLR8
SCHEMBL7984378 0.83 CYP11B1 (0.42) TLR7ALDH1A1
SCHEMBL7984512 0.80 GAA (0.50) MEN1KMT2A
SCHEMBL7975252 0.78 HPGD (0.45) MEN1ALDH1A1KMT2APOLB
SCHEMBL7988129 0.78 MET (0.44) TLR7ALDH1A1KMT2APOLB
SCHEMBL7987443 0.76 GAA (0.37) TLR7MEN1ALDH1A1KMT2A
SCHEMBL7984526 0.76 MET (0.46) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL7985651 0.75 CYP1A2 (0.41) ALDH1A1KMT2A
SCHEMBL7985241 0.75 HSP90AA1 (0.45) HSP90AA1HSP90AB1TLR7PTGS2KDM4E
SCHEMBL7984754 0.74 SMN1; SMN2 (0.47) KDM4E

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