SCHEMBL7974531

SCHEMBL7974531

CCc1nc2ncn(CCc3ccccc3)c2c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
CNOT7 Q9UIV1 8/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.46
TNKS2 Q9H2K2 1/20 0.44
BRD4 O60885 1/20 0.44
MEN1 O00255 1/20 0.43
ADORA3 P0DMS8 1/20 0.42

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
SCHEMBL7974261 0.93 LMNA (0.60) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7985079 0.92 KDM4E (0.49) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7975251 0.88 SMN1; SMN2 (0.60) CNOT7ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7984707 0.87 CNOT7 (0.48) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7988942 0.87 CNOT7 (0.47) KDM4ELMNAPOLBMAPK1CNOT7
Hydrochloric Acid SCHEMBL7984347 0.86 CNOT7 (0.47) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7987233 0.85 LMNA (0.58) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7985770 0.83 CNOT7 (0.50) LMNAPOLBMAPK1CNOT7ALDH1A1
SCHEMBL27746499 0.82 PNP (0.55) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7985534 0.82 L3MBTL1 (0.44) KDM4ELMNAPOLBMAPK1CNOT7

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