SCHEMBL7362874

SCHEMBL7362874

COC(=O)c1cccc(-c2ncccc2C(=O)O)c1CO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 3/20 0.44
PKM P14618 2/20 0.44
ALDH1A1 P00352 5/20 0.44
RORC P51449 1/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
MAP2K1 Q02750 1/20 0.40
NPSR1 Q6W5P4 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
MAPK10 P53779 1/20 0.39
PTK2B Q14289 1/20 0.39
NCOA1 Q15788 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
SCHEMBL7365914 0.88 KDM4E (0.61) KDM4ETDP1L3MBTL1ALDH1A1MEN1
SCHEMBL7365354 0.85 TDP1 (0.50) KDM4ETDP1L3MBTL1PKMALDH1A1
SCHEMBL7369401 0.83 KDM4E (0.46) KDM4ETDP1L3MBTL1PKMALDH1A1
SCHEMBL7365254 0.80 KDM4E (0.54) KDM4ETDP1L3MBTL1PKMALDH1A1
SCHEMBL7363319 0.80 KDM4E (0.54) KDM4ETDP1L3MBTL1ALDH1A1RORC
SCHEMBL8482141 0.79 LMNA (0.47) KDM4EALDH1A1HPGDKMT2AMAPT
SCHEMBL9119782 0.77 TDP1 (0.48) KDM4ETDP1L3MBTL1PKMALDH1A1
SCHEMBL7367740 0.77 KDM4E (0.47) KDM4ETDP1L3MBTL1PKMALDH1A1
SCHEMBL7370854 0.76 KDM4E (0.49) KDM4ETDP1L3MBTL1ALDH1A1MEN1
SCHEMBL7364363 0.75 KDM4E (0.51) KDM4ETDP1L3MBTL1ALDH1A1HTT

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