SCHEMBL7368450

SCHEMBL7368450

COC(=O)c1cc(C(=O)c2cccnc2C(=O)OC)ccc1C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.44
HTT P42858 2/20 0.44
ALOX15 P16050 1/20 0.44
POLB P06746 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
ATM Q13315 1/20 0.41
MAP2K1 Q02750 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.39

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
SCHEMBL7369504 0.92 KDM4E (0.54) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7362977 0.91 ALDH1A1 (0.45) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7369534 0.87 ALDH1A1 (0.48) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7368513 0.83 TDP1 (0.50) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7368006 0.83 L3MBTL1 (0.53) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7365118 0.82 ALOX15 (0.50) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL7367762 0.81 L3MBTL1 (0.50) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL2211216 0.80 L3MBTL1 (0.53) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL29416324 0.80 L3MBTL1 (0.62) L3MBTL1ALDH1A1KDM4EHTTALOX15
SCHEMBL69990 0.80 L3MBTL1 (0.62) L3MBTL1ALDH1A1KDM4EHTTALOX15

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