SCHEMBL7363317

SCHEMBL7363317

COC(=O)c1ccc(-c2nn(-c3ccccc3)c(=O)c3ncccc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.57
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 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
KAT2B Q92831 1/20 0.45
POLB P06746 3/20 0.44
KDM4E B2RXH2 3/20 0.42
MAPT P10636 3/20 0.42
HSP90AA1 P07900 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TNKS O95271 1/20 0.42
ALOX5 P09917 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
SCHEMBL7363944 0.91 ALDH1A1 (0.54) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7370126 0.89 GRM5 (0.48) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7364737 0.88 HPGD (0.53) HPGDMEN1KMT2APDE4APDE4B
SCHEMBL7367503 0.86 HPGD (0.48) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7367676 0.85 NPSR1 (0.49) HPGDALDH1A1PDE4APDE4BPDE4C
SCHEMBL7363039 0.85 PDE4A (0.47) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7365986 0.84 PDE4A (0.53) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7363896 0.83 L3MBTL1 (0.58) HPGDALDH1A1PDE4APDE4BPDE4C
SCHEMBL7367645 0.82 F2RL3 (0.55) HPGDALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7367931 0.81 HPGD (0.55) HPGDALDH1A1SMN1; 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 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