SCHEMBL7989504

SCHEMBL7989504

CNCc1nc(=O)c2c(ncn2Cc2cccc(F)c2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.41
GRIN2B Q13224 3/20 0.41
CNOT7 Q9UIV1 2/20 0.40
PARN O95453 1/20 0.40
DBH P09172 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
YTHDC1 Q96MU7 1/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
P2RX7 Q99572 4/20 0.38
CSNK1E P49674 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE1C Q14123 1/20 0.37

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
SCHEMBL7984210 0.89 GRIN1 (0.43) GRIN1GRIN2BCNOT7PARNNPSR1
SCHEMBL7988359 0.88 ALDH1A1 (0.44) CNOT7PARNNPSR1HPGDALDH1A1
SCHEMBL7987676 0.87 SMN1; SMN2 (0.49) CNOT7PARNDBHYTHDC1P2RX7
SCHEMBL7988487 0.87 PDE1A (0.46) GRIN1GRIN2BCNOT7PARNNPSR1
SCHEMBL7985516 0.87 CNOT7 (0.40) CNOT7PARNKDM4EHPGDP2RX7
SCHEMBL7984366 0.87 CNOT7 (0.53) CNOT7PARNHPGDYTHDC1ALDH1A1
Hydrochloric Acid SCHEMBL7987808 0.86 SMN1; SMN2 (0.48) CNOT7PARNYTHDC1P2RX7MAPK1
Hydrochloric Acid SCHEMBL7988733 0.86 CNOT7 (0.40) CNOT7PARNKDM4EHPGDP2RX7
Hydrochloric Acid SCHEMBL7992068 0.85 CNOT7 (0.52) CNOT7PARNHPGDYTHDC1ALDH1A1
SCHEMBL7986366 0.85 TP53 (0.51) YTHDC1ROCK2ROCK1

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