SCHEMBL7362471

SCHEMBL7362471

COC(=O)c1cccnc1C(=O)c1cccc(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPK1 P28482 2/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
KDM4E B2RXH2 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
POLB P06746 1/20 0.48
BLM P54132 1/20 0.48
ALDH1A1 P00352 3/20 0.47
TP53 P04637 2/20 0.47
HPGD P15428 1/20 0.47
PARP1 P09874 1/20 0.47
CDK5 Q00535 2/20 0.46

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
SCHEMBL7369720 0.90 ELANE (0.49) PKMMEN1KMT2AMAPK1HTT
SCHEMBL7364528 0.88 HTT (0.56) PKMMEN1KMT2AMAPK1HTT
SCHEMBL7370453 0.88 ALOX15 (0.50) MEN1KMT2AHTTTDP1KDM4E
SCHEMBL7368578 0.85 CA1 (0.51) PKMMEN1KMT2AHTTTDP1
SCHEMBL7361925 0.84 TDP1 (0.49) PKMMEN1KMT2AMAPK1HTT
SCHEMBL7362970 0.84 MEN1 (0.49) PKMMEN1KMT2AHTTTDP1
SCHEMBL1252335 0.84 PBRM1 (0.45) PKMKMT2AHTTTDP1KDM4E
SCHEMBL7364891 0.83 TDP1 (0.56) PKMKMT2AHTTTDP1KDM4E
SCHEMBL7370589 0.83 ALDH1A1 (0.55) PKMMEN1KMT2AMAPK1HTT
SCHEMBL7367891 0.80 MEN1 (0.52) PKMMEN1KMT2AHTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716954-A ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES SYNTEX U.S.A. INC. (US) 1998-02-10 US disclosed
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