SCHEMBL9698922

SCHEMBL9698922

CCOC(=O)CC1CCN(C(=O)OC(C)(C)C)C1COC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.33
HCRTR2 O43614 1/20 0.33
SRC P12931 4/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL28668858 0.78 MEN1 (0.34) MEN1KMT2AALDH1A1TSHRSRC
SCHEMBL29496240 0.78 MEN1 (0.40) MEN1KMT2AALDH1A1TSHRSRC
SCHEMBL28704129 0.77 SRC (0.37) MEN1KMT2ASRC
SCHEMBL18044508 0.73 HPGD (0.41) MEN1KMT2AALDH1A1TSHRKDM4E
SCHEMBL9699443 0.73 SRC (0.40) MEN1KMT2ASRCGLA
SCHEMBL24918246 0.73 HCRTR2 (0.40) ALDH1A1HCRTR2HPGDHSD17B10
SCHEMBL30664862 0.73 HCRTR2 (0.40) ALDH1A1HCRTR2HPGDHSD17B10
SCHEMBL29222288 0.73 HCRTR2 (0.40) ALDH1A1HCRTR2HPGDHSD17B10
SCHEMBL10724223 0.73 GABRA1 (0.46) MEN1KMT2AALDH1A1HSD17B10
SCHEMBL1900990 0.73 GABRA1 (0.46) MEN1KMT2AALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992002521-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-20 WO disclosed