SCHEMBL7362607

SCHEMBL7362607

COC(=O)c1cccc(-c2n[nH]c(=O)c3ncccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.53
NEK1 Q96PY6 4/20 0.47
GPR119 Q8TDV5 1/20 0.46
TTK P33981 1/20 0.45
MAPK8 P45983 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAP2K4 P45985 2/20 0.45
CDK8 P49336 1/20 0.45
AXL P30530 1/20 0.44
KDM5B Q9UGL1 1/20 0.44
MAPKAPK3 Q16644 1/20 0.43
MAPK6 Q16659 1/20 0.43
SLC40A1 Q9NP59 1/20 0.43
MAP2K1 Q02750 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
GPR84 Q9NQS5 2/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL7365583 0.92 MAPK1 (0.55) MAPK1NEK1GPR119TTKMAPK8
SCHEMBL7368649 0.87 MAPK1 (0.70) MAPK1ALDH1A1HPGDMAP2K4MAP2K1
SCHEMBL7369500 0.82 MAPK1 (0.48) MAPK1ALDH1A1HPGDMAP2K1KDM4E
SCHEMBL7367420 0.81 DYRK1A (0.49) TTKALDH1A1
SCHEMBL7364011 0.79 MAPK1 (0.73) MAPK1ALDH1A1HPGDMAP2K4KDM4E
SCHEMBL8699836 0.77 TBXAS1 (0.45) NEK1ALDH1A1HPGDL3MBTL1KDM5B
SCHEMBL7364392 0.77 KDM4E (0.51) NEK1ALDH1A1HPGDL3MBTL1CDK8
SCHEMBL3039519 0.76 GPR119 (0.48) MAPK1GPR119ALDH1A1CDK8KDM5B
SCHEMBL7363947 0.76 DCLK1 (0.46) ALDH1A1HPGDALOX15HTTKDM4E
SCHEMBL7370126 0.76 GRM5 (0.48) NEK1ALDH1A1HPGDL3MBTL1AXL

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
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed