SCHEMBL8554532

SCHEMBL8554532

CCOC(=O)C1CN2CCC(C2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
ALDH1A1 P00352 7/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHRM3 P20309 1/20 0.38
TLR4 O00206 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.35

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
SCHEMBL8293162 0.91 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL5419363 0.90 ALDH1A1 (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL4080364 0.73 ALDH1A1 (0.51) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL19360209 0.72 ALDH1A1 (0.53) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL22174706 0.70 MEN1 (0.51) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL27272040 0.70 CYP3A4 (0.44) MAPTALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL4077853 0.70 TLR4 (0.55) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL14810505 0.70 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL11676787 0.69 CYP3A4 (0.43) MAPTALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL3913430 0.68 MEN1 (0.52) MAPTALDH1A1MEN1KMT2AKDM4E

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
EP-0544773-B1 AZABICYCLIC COMPOUNDS, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1998-03-18 EP disclosed
US-5362739-A Acetylcholine activators, dementia treatment BEECHAM GROUP P.L.C. (GB) 1994-11-08 US disclosed
WO-1992003435-A1 AZABICYCLIC COMPOUNDS, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1992-03-05 WO disclosed