SCHEMBL7366676

SCHEMBL7366676

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
GAA P10253 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
HPGD P15428 5/20 0.46
HTT P42858 3/20 0.46
TP53 P04637 6/20 0.44
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 5/20 0.43
CYP1A2 P05177 4/20 0.43
USP2 O75604 3/20 0.43
CLK4 Q9HAZ1 3/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP2C9 P11712 1/20 0.43
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CYP2D6 P10635 2/20 0.43
ADORA3 P0DMS8 1/20 0.43

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
SCHEMBL7367503 0.91 HPGD (0.48) NCOA1NCOA3GAANPSR1MEN1
SCHEMBL7367332 0.89 HTT (0.53) GAANPSR1MEN1KMT2AHPGD
SCHEMBL7361460 0.86 NPSR1 (0.49) GAANPSR1HPGDHTTALDH1A1
SCHEMBL7363944 0.86 ALDH1A1 (0.54) GAANPSR1MEN1KMT2AHPGD
SCHEMBL9168570 0.84 NPSR1 (0.56) GAANPSR1HTTALDH1A1CYP1A2
SCHEMBL7366959 0.83 L3MBTL1 (0.58) GAANPSR1HPGDALDH1A1CYP2C9
SCHEMBL7365955 0.83 PDE4A (0.52) NCOA1NCOA3NPSR1MEN1KMT2A
SCHEMBL7366633 0.82 NCOA1 (0.46) NCOA1NCOA3GAAMEN1KMT2A
SCHEMBL7368776 0.82 NCOA1 (0.46) NCOA1NCOA3GAAMEN1KMT2A
SCHEMBL7361949 0.81 PDE4A (0.53) GAANPSR1MEN1KMT2AHPGD

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