SCHEMBL7369534

SCHEMBL7369534

COC(=O)c1cc(C(=O)c2ncccc2C(=O)O)ccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 5/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
MAPT P10636 2/20 0.48
ALOX15 P16050 2/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
BLM P54132 1/20 0.48
AGER Q15109 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.42
HTT P42858 2/20 0.42
POLB P06746 1/20 0.42
PKM P14618 2/20 0.41

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
SCHEMBL7362977 0.94 ALDH1A1 (0.45) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7369504 0.90 KDM4E (0.54) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7368450 0.87 L3MBTL1 (0.46) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7362858 0.84 KDM4E (0.56) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7366436 0.83 KDM4E (0.51) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7360249 0.81 KDM4E (0.51) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7364978 0.79 MAPT (0.52) ALDH1A1KDM4EL3MBTL1MAPTTSHR
SCHEMBL7366038 0.79 KDM4E (0.50) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7364891 0.78 TDP1 (0.56) ALDH1A1KDM4EL3MBTL1MAPTALOX15
SCHEMBL7367891 0.78 MEN1 (0.52) ALDH1A1KDM4EL3MBTL1MAPTALOX15

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