SCHEMBL14392136

SCHEMBL14392136

CCC[C@H](CNC)N(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 7/20 0.32
OPRK1 P41145 7/20 0.32

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
SCHEMBL13397769 0.81 OPRD1 (0.36) OPRD1OPRK1
SCHEMBL19850132 0.79
SCHEMBL19402459 0.79
SCHEMBL19402489 0.79
SCHEMBL19402460 0.79
SCHEMBL23397852 0.78
SCHEMBL16752067 0.78 OPRD1 (0.31) OPRD1OPRK1
SCHEMBL31442725 0.78 PRMT3 (0.40) OPRD1OPRK1
SCHEMBL16752028 0.78 OPRD1 (0.34) OPRD1OPRK1
SCHEMBL3361400 0.78 TSHR (0.32)

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-2007121920-A2 PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2007-11-01 WO disclosed