SCHEMBL21885823

SCHEMBL21885823

C=C1CC(CC(C)C)CCN1C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.31
PIK3CD O00329 1/20 0.30

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
SCHEMBL19570437 0.78 BRD4 (0.43) OPRK1PIK3CD
SCHEMBL13699259 0.71
SCHEMBL6331472 0.69
SCHEMBL23710964 0.69 OPRK1 (0.33) OPRK1
SCHEMBL102076 0.69 NCF1 (0.52) OPRK1
SCHEMBL22020557 0.67 NCF1 (0.44) OPRK1PIK3CD
SCHEMBL23645702 0.67 NCF1 (0.44) OPRK1PIK3CD
SCHEMBL8235125 0.67 NCF1 (0.44) OPRK1PIK3CD
SCHEMBL23806425 0.66 MAPT (0.47) OPRK1
SCHEMBL23863913 0.66 MME (0.36) OPRK1PIK3CD

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-2020073011-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. (US) 2020-04-09 WO disclosed