SCHEMBL7985296

SCHEMBL7985296

CC(C)(C)OC(=O)NCCCc1nc(=O)c2c(ncn2Cc2ccccc2)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARN O95453 1/20 0.44
CNOT7 Q9UIV1 1/20 0.44
SIGMAR1 Q99720 3/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 1/20 0.40
TLR7 Q9NYK1 4/20 0.39
P2RX7 Q99572 1/20 0.39
BCHE P06276 1/20 0.39
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
PGGT1B P53609 1/20 0.39
KCNH2 Q12809 1/20 0.39
IDO1 P14902 1/20 0.38
NPFFR1 Q9GZQ6 1/20 0.38
NPFFR2 Q9Y5X5 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7991663 0.94 CNOT7 (0.45) PARNCNOT7SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL7985298 0.86 ALDH1A1 (0.52) PARNCNOT7SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL7974030 0.84 CNOT7 (0.42) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
SCHEMBL7988844 0.82 CNOT7 (0.49) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
SCHEMBL7988921 0.82 CNOT7 (0.44) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL7975100 0.81 CNOT7 (0.48) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
SCHEMBL7991666 0.81 SMN1; SMN2 (0.53) PARNCNOT7SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL7985704 0.81 CNOT7 (0.50) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
SCHEMBL7987612 0.80 CNOT7 (0.51) PARNCNOT7ALDH1A1SMN1; SMN2HPGD
SCHEMBL7985460 0.80 CNOT7 (0.45) PARNCNOT7ALDH1A1SMN1; SMN2HPGD

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