SCHEMBL25049539

SCHEMBL25049539

CN1CCC[C@@]2(CCN2)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
CHRNB2 P17787 3/20 0.32
CHRNA4 P43681 3/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA1 P02708 1/20 0.32
CHRNG P07510 1/20 0.32
CHRNB1 P11230 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRND Q07001 1/20 0.32
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL18968285 1.00 USP2 (0.33) USP2CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL23865694 0.93 CHRNA1 (0.37) USP2CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL10062591 0.93 CHRNA1 (0.37) USP2CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL10062590 0.91 CDC42BPB (0.34) USP2CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL12926362 0.86 SIGMAR1 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL12958765 0.86 SIGMAR1 (0.33) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL12309899 0.86
SCHEMBL90414 0.84 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL13859631 0.84 SIGMAR1 (0.38) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1
SCHEMBL26441355 0.84 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA1

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-2023018810-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2023-02-16 WO disclosed