SCHEMBL7984378

SCHEMBL7984378

CCc1nc(O)c2c(ncn2Cc2cc(C)cc(C)c2)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.42
CYP11B2 P19099 3/20 0.42
ALDH1A1 P00352 2/20 0.32
TLR7 Q9NYK1 2/20 0.31
HPGD P15428 1/20 0.31
MET P08581 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7987960 0.90 CYP11B1 (0.32) CYP11B1CYP11B2TLR7HPGD
SCHEMBL7974260 0.89 CYP11B1 (0.47) CYP11B1CYP11B2ALDH1A1HPGDGAA
SCHEMBL7987434 0.88 CYP11B1 (0.42) CYP11B1CYP11B2ALDH1A1TLR7HPGD
SCHEMBL7988129 0.84 MET (0.44) ALDH1A1TLR7HPGDMETGAA
SCHEMBL7975252 0.84 HPGD (0.45) CYP11B1CYP11B2ALDH1A1HPGDGAA
SCHEMBL7985521 0.84 ALDH1A1 (0.41) ALDH1A1HPGDGAASMN1; SMN2
SCHEMBL7985245 0.83 HSP90AA1 (0.44) ALDH1A1TLR7
SCHEMBL7984526 0.82 MET (0.46) CYP11B1CYP11B2ALDH1A1HPGDMET
SCHEMBL7974271 0.81 TNF (0.46) ALDH1A1TLR7GAASMN1; SMN2
SCHEMBL7984754 0.80 SMN1; SMN2 (0.47) CYP11B1CYP11B2GAASMN1; SMN2

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