SCHEMBL7367332

SCHEMBL7367332

O=C(O)c1ccc(-c2nn(-c3ccccc3)c(=O)c3cccnc23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
NPSR1 Q6W5P4 2/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.50
PLA2G10 O15496 1/20 0.47
ADORA3 P0DMS8 2/20 0.46
RORC P51449 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KAT2B Q92831 1/20 0.43
ALOX5 P09917 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
LMNA P02545 1/20 0.42
ENPP1 P22413 1/20 0.42
MAP2K4 P45985 1/20 0.42
PSMB5 P28074 1/20 0.42

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
SCHEMBL7361460 0.91 NPSR1 (0.49) HTTNPSR1GAAHPGDADORA3
SCHEMBL7364737 0.90 HPGD (0.53) HTTNPSR1GAAHPGDPLA2G10
SCHEMBL7366676 0.89 NCOA1 (0.48) HTTNPSR1GAAHPGDADORA3
SCHEMBL9168570 0.88 NPSR1 (0.56) HTTNPSR1GAAADORA3ALDH1A1
SCHEMBL7363944 0.88 ALDH1A1 (0.54) HTTNPSR1GAAHPGDADORA3
SCHEMBL7366959 0.85 L3MBTL1 (0.58) NPSR1GAAHPGDALDH1A1ALOX5
SCHEMBL7361949 0.82 PDE4A (0.53) HTTNPSR1GAAHPGDADORA3
SCHEMBL7367676 0.81 NPSR1 (0.49) HTTNPSR1GAAHPGDADORA3
SCHEMBL7361626 0.80 ALDH1A1 (0.56) HTTNPSR1HPGDRORCALDH1A1
SCHEMBL9165637 0.80 NPSR1 (0.56) HTTNPSR1GAAHPGDALDH1A1

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