SCHEMBL7985523

SCHEMBL7985523

CCc1nc(=O)c2c(ncn2Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 8/20 0.38
KDM4E B2RXH2 4/20 0.38
MAPT P10636 3/20 0.38
CNOT7 Q9UIV1 3/20 0.36
PARN O95453 1/20 0.36
TSHR P16473 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
MAPK1 P28482 2/20 0.35
BLM P54132 2/20 0.35
ATM Q13315 2/20 0.35
HIF1A Q16665 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
USP2 O75604 1/20 0.35
CYP2D6 P10635 1/20 0.35
GAA P10253 6/20 0.35
LMNA P02545 3/20 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
SCHEMBL7984380 0.83 CYP11B1 (0.40) ALDH1A1KDM4EMAPTCNOT7PARN
SCHEMBL7985527 0.83 HPGD (0.41) TDP1ALDH1A1KDM4EMAPTTSHR
SCHEMBL7992340 0.82 CNOT7 (0.40) ALDH1A1CNOT7PARNKMT2AMEN1
SCHEMBL7984470 0.81 ABCC8 (0.50) TDP1CNOT7PARNKMT2AMEN1
SCHEMBL7988132 0.81 CNOT7 (0.44) ALDH1A1CNOT7PARNMAPK1LMNA
SCHEMBL7975254 0.78 CNOT7 (0.55) ALDH1A1CNOT7PARNKMT2AHIF1A
SCHEMBL7986239 0.77 CNOT7 (0.47) ALDH1A1CNOT7PARNKMT2AMEN1
SCHEMBL7987439 0.77 CNOT7 (0.43) ALDH1A1KDM4EMAPTCNOT7PARN
SCHEMBL7985247 0.77 HSP90AA1 (0.45) KDM4EKMT2AMEN1LMNA
SCHEMBL7984530 0.76 HPGD (0.46) ALDH1A1KDM4ECNOT7PARNKMT2A

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