SCHEMBL7984530

SCHEMBL7984530

CCc1nc(=O)c2c(ncn2Cc2ccc(F)cc2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
CNOT7 Q9UIV1 2/20 0.42
PARN O95453 1/20 0.42
P2RX7 Q99572 4/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CYP11B2 P19099 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SOS1 Q07889 1/20 0.38
BRDT Q58F21 1/20 0.38

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
SCHEMBL7988961 0.91 KDM4E (0.42) HPGDCNOT7PARNP2RX7KDM4E
SCHEMBL7987439 0.89 CNOT7 (0.43) HPGDCNOT7PARNKDM4EALDH1A1
SCHEMBL7985516 0.88 CNOT7 (0.40) HPGDCNOT7PARNP2RX7KDM4E
SCHEMBL7988132 0.88 CNOT7 (0.44) HPGDCNOT7PARNALDH1A1SMN1; SMN2
SCHEMBL7975254 0.88 CNOT7 (0.55) HPGDCNOT7PARNALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7988733 0.87 CNOT7 (0.40) HPGDCNOT7PARNP2RX7KDM4E
SCHEMBL7984210 0.86 GRIN1 (0.43) HPGDCNOT7PARNP2RX7KDM4E
SCHEMBL7974307 0.86 CNOT7 (0.40) HPGDCNOT7PARNP2RX7KDM4E
SCHEMBL7984470 0.86 ABCC8 (0.50) HPGDCNOT7PARNSMN1; SMN2CYP11B2
SCHEMBL7973938 0.86 CNOT7 (0.48) HPGDCNOT7PARNALDH1A1SMN1; SMN2

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