SCHEMBL10064412

SCHEMBL10064412

CCCCNCCNCCNCCCCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.76
L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL9819750 0.98 SIGMAR1 (0.79) SIGMAR1L3MBTL1
SCHEMBL8625670 0.96 SIGMAR1 (0.81) SIGMAR1L3MBTL1
SCHEMBL9819972 0.94 SIGMAR1 (0.85) SIGMAR1L3MBTL1
SCHEMBL29107049 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL9034885 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL9819852 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL9213367 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL11132388 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL29266756 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1
SCHEMBL3109628 0.92 SIGMAR1 (0.79) SIGMAR1

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-2012027727-A2 LIPOMACROCYCLES AND USES THEREOF CUI KUNYUAN (US) 2012-03-01 WO disclosed