SCHEMBL7362858

SCHEMBL7362858

COC(=O)c1ccc(C(=O)c2ncccc2C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
ALDH1A1 P00352 5/20 0.56
MAPT P10636 5/20 0.56
L3MBTL1 Q9Y468 5/20 0.56
ALOX15 P16050 2/20 0.56
TSHR P16473 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
CYP3A4 P08684 1/20 0.56
BLM P54132 1/20 0.56
AGER Q15109 1/20 0.56
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
DHODH Q02127 1/20 0.48
HTT P42858 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL7367891 0.91 MEN1 (0.52) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7360329 0.88 KDM4E (0.56) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7360249 0.88 KDM4E (0.51) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7366436 0.87 KDM4E (0.51) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL2881107 0.85 ALDH1A1 (0.57) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7364891 0.85 TDP1 (0.56) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7368006 0.85 L3MBTL1 (0.53) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL29559479 0.84 KDM4E (0.67) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL519094 0.84 KDM4E (0.67) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7369102 0.84 KDM4E (0.67) KDM4EALDH1A1MAPTL3MBTL1ALOX15

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