SCHEMBL23484356

SCHEMBL23484356

CC(C)(C)OC(=O)N1CCC2(CC1)CN(C1CC(CO)C1)C(=O)O2

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.46
GPR119 Q8TDV5 8/20 0.37
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
EPHX2 P34913 1/20 0.35
TP53 P04637 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
SCHEMBL23481174 0.83 HRH3 (0.43) GPR119USP2SMN1; SMN2HRH3DDB1
SCHEMBL24993819 0.83 NR1H2 (0.36) NR1H2HRH3
SCHEMBL23484250 0.78 GPR119 (0.35) NR1H2GPR119USP2SMN1; SMN2HRH3
SCHEMBL23459192 0.77 HRH3 (0.36) GPR119USP2SMN1; SMN2HRH3DDB1
SCHEMBL23459191 0.77 HRH3 (0.36) GPR119USP2SMN1; SMN2HRH3DDB1
SCHEMBL23459309 0.77 HRH3 (0.36) GPR119USP2SMN1; SMN2HRH3DDB1
SCHEMBL3035597 0.76 USP2 (0.45) GPR119USP2SMN1; SMN2DDB1CRBN
SCHEMBL7840359 0.76 USP2 (0.45) GPR119USP2SMN1; SMN2HRH3DDB1
SCHEMBL23460060 0.75 HSD11B1 (0.31)
SCHEMBL23481314 0.74 USP2 (0.37) NR1H2GPR119USP2SMN1; SMN2DDB1

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-4073075-A1 SSTR5 ANTAGONISTS Kallyope, Inc. (US) 2022-10-19 EP disclosed
WO-2021113362-A1 SSTR5 ANTAGONISTS KALLYOPE, INC. (US) 2021-06-10 WO disclosed