SCHEMBL22795457

SCHEMBL22795457

CC[C@@H](CCC(C)C)C1CCCNC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.38
CPB2 Q96IY4 1/20 0.38
KCNH2 Q12809 1/20 0.32
SHBG P04278 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
SCHEMBL23469236 1.00 CPN1 (0.38) CPN1CPB2KCNH2SHBG
SCHEMBL13259733 0.86 CPN1 (0.40) CPN1CPB2KCNH2SHBG
SCHEMBL13952152 0.85 CPN1 (0.44) CPN1CPB2KCNH2SHBG
SCHEMBL6863922 0.85 CPN1 (0.44) CPN1CPB2KCNH2SHBG
SCHEMBL13285534 0.83 CPN1 (0.38) CPN1CPB2KCNH2SHBG
SCHEMBL21911259 0.80 SHBG (0.41) CPN1CPB2KCNH2SHBG
SCHEMBL19881822 0.77 CCR2 (0.35)
SCHEMBL1547696 0.76 CPN1 (0.47) CPN1CPB2KCNH2SHBG
SCHEMBL12913065 0.76 CPN1 (0.47) CPN1CPB2KCNH2SHBG
SCHEMBL23709494 0.75 CPN1 (0.40) CPN1CPB2KCNH2

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-2020252383-A2 COMPOUNDS FOR THE MODULATION OF PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) SRX CARDIO, LLC (US) 2020-12-17 WO disclosed