SCHEMBL5344249

SCHEMBL5344249

CCc1cccc2c(=O)[nH]c3c4ccccc4n(C(=O)O)c3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 4/20 0.43
P2RX4 Q99571 1/20 0.39
LCK P06239 1/20 0.36
PRKACA P17612 1/20 0.36
CSNK2A2 P19784 1/20 0.36
PRKACG P22612 1/20 0.36
PRKACB P22694 1/20 0.36
GSK3B P49841 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
DYRK1A Q13627 1/20 0.36
CSNK2A3 Q8NEV1 1/20 0.36
MALT1 Q9UDY8 1/20 0.36
FEN1 P39748 1/20 0.36
PGR P06401 1/20 0.36
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PTPN5 P54829 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
SCHEMBL5354068 0.90 AGTR1 (0.40) DAOP2RX4POLBALDH1A1HPGD
SCHEMBL14397606 0.71 ALDH1A1 (0.51) GAAPOLBALDH1A1HPGD
SCHEMBL1696713 0.70 POLB (0.45) DAOP2RX4GAALMNAMAPT
SCHEMBL14397205 0.68 ALDH1A1 (0.42) P2RX4GAALMNAALDH1A1HPGD
SCHEMBL27888984 0.68 LCK (0.48) DAOP2RX4LCKPRKACACSNK2A2
SCHEMBL14397212 0.68 ALDH1A1 (0.40) P2RX4GAALMNAPOLBALDH1A1
SCHEMBL14396760 0.68 ALDH1A1 (0.47) PGRGAALMNAPOLBALDH1A1
SCHEMBL14397210 0.67 GAA (0.45) GAALMNAMAPTPOLBALDH1A1
SCHEMBL14396752 0.66 HPGD (0.44) P2RX4GAALMNAMAPTPOLB
SCHEMBL2915651 0.66 LCK (0.46) P2RX4LCKPRKACACSNK2A2PRKACG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007117289-A2 METHODS FOR TREATING OR PREVENTING ERECTILE DYSFUNCTION OR URINARY INCONTINENCE INOTEK PHARMACEUTICALS CORPORATION (US) 2007-10-18 WO disclosed