SCHEMBL7974282

SCHEMBL7974282

CC(C)(C)c1ccc(Cn2cnc3[nH]c(-c4cccc(O)c4)nc(=O)c32)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCC8 Q09428 1/20 0.43
KCNJ11 Q14654 1/20 0.43
NR1H4 Q96RI1 5/20 0.39
CNOT7 Q9UIV1 2/20 0.39
PARN O95453 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC1 Q13547 1/20 0.38
NLRP3 Q96P20 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.36
HSD17B13 Q7Z5P4 1/20 0.36
SERPINE1 P05121 1/20 0.35
PIK3CA P42336 1/20 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
SCHEMBL7991403 0.89 ABCC8 (0.43) ABCC8KCNJ11NR1H4CNOT7PARN
SCHEMBL7985012 0.89 ABCC8 (0.43) ABCC8KCNJ11NR1H4CNOT7PARN
SCHEMBL7985568 0.89 CNOT7 (0.41) CNOT7PARNHDAC6HDAC1HSD17B13
SCHEMBL7992270 0.89 ABCC8 (0.43) ABCC8KCNJ11NR1H4CNOT7PARN
SCHEMBL7974492 0.88 ABCC8 (0.47) ABCC8KCNJ11NR1H4CNOT7PARN
SCHEMBL7985342 0.88 CNOT7 (0.51) CNOT7PARN
SCHEMBL7984474 0.88 ABCC8 (0.42) ABCC8KCNJ11NR1H4CNOT7PARN
SCHEMBL7988017 0.88 KDM4E (0.43) ABCC8KCNJ11HDAC6HDAC1
SCHEMBL7985619 0.87 CNOT7 (0.41) CNOT7PARNHDAC6HDAC1HSD17B13
SCHEMBL7985602 0.87 SERPINE1 (0.45) ABCC8KCNJ11HDAC6HDAC1SERPINE1

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