SCHEMBL18975737

SCHEMBL18975737

CCC(O)N1CC(=CC#N)C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 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
SCHEMBL18975875 0.86 DRD3 (0.35) DRD3
SCHEMBL24943290 0.76 DRD3 (0.32) DRD3
SCHEMBL21341346 0.71
SCHEMBL28158154 0.67 DRD3 (0.33) DRD3
SCHEMBL18975587 0.67 ALDH1A1 (0.36) DRD3
SCHEMBL23343604 0.64 GRM5 (0.51)
SCHEMBL18975926 0.63 DRD3 (0.33) DRD3
SCHEMBL3923601 0.62
SCHEMBL11730803 0.62 TSHR (0.37)
SCHEMBL636365 0.62 TSHR (0.37)

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-2017097224-A1 AZETIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2017-06-15 WO disclosed