SCHEMBL7974203

SCHEMBL7974203

O=c1nc(-c2cccc(Cl)c2)[nH]c2ncn(Cc3ccccc3F)c12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.41
MAPT P10636 1/20 0.40
P2RX7 Q99572 3/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
IDO1 P14902 1/20 0.39
HSD17B13 Q7Z5P4 1/20 0.38
CXCR2 P25025 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
HRH1 P35367 1/20 0.37
PARN O95453 1/20 0.36
CNOT7 Q9UIV1 1/20 0.36

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
SCHEMBL7988753 0.90 ACP1 (0.41) ACP1P2RX7PDE4APDE4BPDE4C
SCHEMBL7985415 0.89 ALDH1A1 (0.39) P2RX7PDE4APDE4BPDE4CPDE4D
SCHEMBL7987224 0.88 LMNA (0.44) P2RX7PDE4APDE4BPDE4CPDE4D
SCHEMBL7984682 0.88 PDE4A (0.39) P2RX7PDE4APDE4BPDE4CPDE4D
SCHEMBL7974015 0.86 PARN (0.49) ACP1IDO1CXCR2ALDH1A1PARN
SCHEMBL7988784 0.86 MAPK1 (0.43) ACP1IDO1CXCR2LMNAPARN
SCHEMBL7988416 0.85 ALDH1A1 (0.49) P2RX7ALDH1A1
SCHEMBL7973628 0.84 SMN1; SMN2 (0.48) ACP1P2RX7IDO1CXCR2PARN
SCHEMBL7986760 0.84 ALDH1A1 (0.41) ACP1P2RX7PDE4APDE4BPDE4C
SCHEMBL7974198 0.84 LMNA (0.41) ACP1MAPTPDE4APDE4BPDE4C

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