SCHEMBL7988487

SCHEMBL7988487

CCCc1nc(=O)c2c(ncn2Cc2cccc(F)c2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 1/20 0.46
PDE1B Q01064 1/20 0.46
PDE1C Q14123 1/20 0.46
GRIN1 Q05586 4/20 0.41
GRIN2B Q13224 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
PARN O95453 1/20 0.40
CNOT7 Q9UIV1 1/20 0.40
P2RX7 Q99572 3/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
ROCK2 O75116 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
SCHEMBL7984210 0.91 GRIN1 (0.43) PDE1APDE1BPDE1CGRIN1GRIN2B
SCHEMBL7988534 0.89 TAAR1 (0.41) PDE1APDE1BPDE1CGRIN1GRIN2B
SCHEMBL7988665 0.88 ALDH1A1 (0.44) ALDH1A1TSHRPARNCNOT7HPGD
SCHEMBL7991727 0.87 SMN1; SMN2 (0.49) MAPK1PARNCNOT7P2RX7
SCHEMBL7989504 0.87 GRIN1 (0.41) PDE1APDE1BPDE1CGRIN1GRIN2B
SCHEMBL7988961 0.87 KDM4E (0.42) ALDH1A1TSHRMAPK1PARNCNOT7
SCHEMBL7989411 0.87 CNOT7 (0.53) ALDH1A1PARNCNOT7HPGDADORA2B
SCHEMBL7984139 0.85 TP53 (0.51) ALDH1A1TSHRMAPK1HPGDROCK2
SCHEMBL7988482 0.83 PDE1A (0.46) PDE1APDE1BPDE1CGRIN1GRIN2B
SCHEMBL7985863 0.82 CNOT7 (0.57) ALDH1A1PKMPARNCNOT7KDM4E

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