SCHEMBL7985482

SCHEMBL7985482

CN(C(=O)OC(C)(C)C)c1ccc(-c2nc(=O)c3c(ncn3Cc3ccccc3)[nH]2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.43
PARN O95453 1/20 0.42
CNOT7 Q9UIV1 1/20 0.42
HPGD P15428 1/20 0.39
ADORA2B P29275 2/20 0.38
P2RX7 Q99572 2/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MCL1 Q07820 1/20 0.36
BRD4 O60885 2/20 0.35
CREBBP Q92793 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
PRMT5 O14744 1/20 0.34
PNP P00491 1/20 0.34

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
SCHEMBL7984731 0.91 ABCC8 (0.39) PAX8PARNCNOT7BRD4CREBBP
SCHEMBL7974157 0.91 BRD4 (0.44) PAX8PARNCNOT7HPGDP2RX7
SCHEMBL7985473 0.86 HPGD (0.49) PAX8PARNCNOT7HPGDADORA2B
SCHEMBL7984489 0.84 P2RX7 (0.45) PARNCNOT7HPGDADORA2BP2RX7
SCHEMBL7988795 0.83 BRD4 (0.40) PAX8PARNCNOT7BRD4
SCHEMBL7985460 0.80 CNOT7 (0.45) PARNCNOT7HPGDP2RX7ALDH1A1
SCHEMBL7975271 0.80 CNOT7 (0.56) PARNCNOT7HPGDADORA2BALDH1A1
SCHEMBL7974030 0.79 CNOT7 (0.42) PARNCNOT7HPGDP2RX7ALDH1A1
SCHEMBL7988562 0.79 CNOT7 (0.54) PARNCNOT7HPGDADORA2BALDH1A1
SCHEMBL7988921 0.79 CNOT7 (0.44) PARNCNOT7HPGDP2RX7ALDH1A1

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