SCHEMBL6025282

SCHEMBL6025282

CC(=O)Oc1c(C)n(C(=O)c2cccc(Cl)c2)c2ccc(O)cc12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.47
PTGS2 P35354 4/20 0.47
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
ELANE P08246 3/20 0.40
ABCB11 O95342 1/20 0.39
PPARG P37231 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX5 P09917 1/20 0.37

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
SCHEMBL5553721 0.88 AKR1C3 (0.44) PTGS1PTGS2MAPTPKMKMT2A
SCHEMBL5822002 0.87 CNR2 (0.58) PTGS1PTGS2CNR1CNR2MAPT
SCHEMBL6025591 0.85 PTGS2 (0.48) PTGS1PTGS2CNR2MAPTKMT2A
SCHEMBL5560588 0.84 MAPT (0.39) PTGS2CNR1CNR2MAPTPKM
SCHEMBL5799040 0.83 PTGS2 (0.46) PTGS1PTGS2MAPTPKMKMT2A
SCHEMBL5800412 0.83 PTGS2 (0.46) PTGS1PTGS2MAPTKMT2AABCB11
SCHEMBL6025157 0.82 PTGS1 (0.45) PTGS1PTGS2CNR1CNR2MAPT
SCHEMBL6025108 0.81 CNR2 (0.47) PTGS1PTGS2CNR1CNR2MAPT
SCHEMBL5558582 0.81 PTGS2 (0.47) PTGS1PTGS2LMNAHPGDHTT
SCHEMBL5814619 0.80 CNR1 (0.38) PTGS2CNR1CNR2MAPTPKM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1628532-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION Microbia, Inc. (US) 2006-03-01 EP claimed
WO-2004108085-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION MICROBIA, INC. (US) 2004-12-16 WO claimed
EP-1628532-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION Microbia, Inc. (US) 2006-03-01 EP disclosed
WO-2004108085-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION MICROBIA, INC. (US) 2004-12-16 WO disclosed