SCHEMBL7984934

SCHEMBL7984934

CC(C)(C)c1ccc(Cn2cnc3[nH]c(-c4ccncc4)nc(=O)c32)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 3/20 0.47
ABCC8 Q09428 1/20 0.47
KCNJ11 Q14654 1/20 0.47
GCGR P47871 1/20 0.42
RIPK3 Q9Y572 1/20 0.39
PARN O95453 1/20 0.38
KIF11 P52732 1/20 0.37
NR1H4 Q96RI1 3/20 0.36
TNKS O95271 2/20 0.35
TNKS2 Q9H2K2 2/20 0.35
PARP1 P09874 1/20 0.35
METAP2 P50579 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GRK2 P25098 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
SCHEMBL7974492 0.90 ABCC8 (0.47) CNOT7ABCC8KCNJ11PARNNR1H4
SCHEMBL7988524 0.89 ABCC8 (0.47) CNOT7ABCC8KCNJ11PARNNR1H4
SCHEMBL7987364 0.88 TNKS (0.46) CNOT7ABCC8KCNJ11RIPK3PARN
SCHEMBL7985827 0.88 CNOT7 (0.49) CNOT7GCGRRIPK3PARNLMNA
SCHEMBL7974239 0.88 CNOT7 (0.45) CNOT7ABCC8KCNJ11PARNKIF11
SCHEMBL7984871 0.88 ABCC8 (0.45) CNOT7ABCC8KCNJ11PARNNR1H4
SCHEMBL7985279 0.86 CNOT7 (0.49) CNOT7GCGRPARNLMNAKDM4E
SCHEMBL7974444 0.85 CNOT7 (0.52) CNOT7PARNKDM4EHSD17B10GRK2
SCHEMBL7985012 0.84 ABCC8 (0.43) CNOT7ABCC8KCNJ11PARNNR1H4
SCHEMBL7991403 0.84 ABCC8 (0.43) CNOT7ABCC8KCNJ11PARNNR1H4

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