SCHEMBL7363944

SCHEMBL7363944

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
KAT2B Q92831 1/20 0.47
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ADORA3 P0DMS8 4/20 0.45
POLB P06746 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HSP90AA1 P07900 1/20 0.42
TDP1 Q9NUW8 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
SCHEMBL7363317 0.91 HPGD (0.57) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL7363279 0.89 GRM5 (0.48) ALDH1A1HPGDMEN1KMT2AKAT2B
SCHEMBL7367332 0.88 HTT (0.53) ALDH1A1HPGDMEN1KMT2AKAT2B
SCHEMBL7366676 0.86 NCOA1 (0.48) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL7361460 0.85 NPSR1 (0.49) ALDH1A1HPGDPDE4APDE4BPDE4C
SCHEMBL7363855 0.85 PDE4A (0.47) ALDH1A1HPGDMEN1KMT2AMAPK1
SCHEMBL7361949 0.84 PDE4A (0.53) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL9168570 0.83 NPSR1 (0.56) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL7366959 0.83 L3MBTL1 (0.58) ALDH1A1HPGDPDE4APDE4BPDE4C
SCHEMBL7367052 0.82 F2RL3 (0.53) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A

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