SCHEMBL6026089

SCHEMBL6026089

COc1ccc2c(c1)c(OC(C)=O)c(C)n2C(=O)N1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.56
POLB P06746 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 4/20 0.43
KDM4E B2RXH2 3/20 0.43
CES2 O00748 1/20 0.43
USP14 P54578 1/20 0.42
RYR2 Q92736 1/20 0.42
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
RAB9A P51151 1/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 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
SCHEMBL27905740 0.86 CNR2 (0.41) CNR2POLBMEN1KMT2AHSD17B10
SCHEMBL8668045 0.79 POLB (0.46) POLBMEN1KMT2AHSD17B10ALDH1A1
SCHEMBL2004993 0.79 CNR2 (0.66) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL8579955 0.77 LMNA (0.65) MEN1KMT2AKDM4EMAPTHTT
SCHEMBL5822660 0.75 AKR1C3 (0.65) MEN1KMT2AKDM4EMAPTRAB9A
SCHEMBL1076364 0.75 PTGS2 (0.65) CNR2MEN1KMT2AKDM4EMAPT
SCHEMBL3240338 0.74 PTGS1 (0.48) CNR2POLBMEN1KMT2AKDM4E
SCHEMBL3252299 0.74 CNR2 (0.56) CNR2POLBMEN1KMT2AHPGD
SCHEMBL11436509 0.74 PTGS2 (0.64) CNR2MEN1KMT2AKDM4EMAPT
SCHEMBL5799148 0.73 PTGS2 (0.52) CNR2MEN1KMT2AKDM4EMAPT

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