SCHEMBL8320339

SCHEMBL8320339

CCOC(=O)N1C2C=CC1CCC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
THRB P10828 1/20 0.40
ATM Q13315 1/20 0.40
CHRM1 P11229 3/20 0.40
GAA P10253 1/20 0.40
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
KMT2A Q03164 2/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 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
SCHEMBL7052178 0.92 GAA (0.42) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL29822414 0.78 CHRM1 (0.49) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL3838195 0.78 KMT2A (0.46) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL19627195 0.78 ATM (0.35) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL17354962 0.76 CHRM1 (0.51) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL13321596 0.76 CHRM1 (0.55) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL304292 0.76 CHRM1 (0.55) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL10063523 0.76 CHRM1 (0.51) ALDH1A1L3MBTL1THRBATMCHRM1
SCHEMBL8484640 0.74 CHRM1 (0.36) ALDH1A1L3MBTL1CHRM1GAANOS3
SCHEMBL3843370 0.74 KMT2A (0.50) ALDH1A1L3MBTL1THRBATMCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944627-A1 8-AZABICYCLO 3.2.1]OCTANE-, 8-AZABICYCLO 3.2.1]OCT-6-ENE-, 9-AZABICYCLO 3.3.1]NONANE-, 9-AZA-3-OXABICYCLO 3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO 3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1999-09-29 EP disclosed
WO-1998025924-A1 8-AZABICYCLO[3.2.1]OCTANE-, 8-AZABICYCLO[3.2.1]OCT-6-ENE-, 9-AZABICYCLO[3.3.1]NONANE-, 9-AZA-3-OXABICYCLO[3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO[3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1998-06-18 WO disclosed