SCHEMBL21620145

SCHEMBL21620145

COCCCCC1(C)CCCCN1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.33
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL21619625 0.78 SLC6A4 (0.35) SLC6A4
SCHEMBL7000165 0.76 SLC6A4 (0.35) SLC6A4
SCHEMBL744196 0.76 SLC6A4 (0.35) SLC6A4
SCHEMBL30761086 0.75 SLC6A4 (0.31) SLC6A4
SCHEMBL13156115 0.75 SLC6A4 (0.31) SLC6A4
SCHEMBL22338492 0.74 ARG1 (0.50) SLC6A4
SCHEMBL14536445 0.73 SLC6A4 (0.34) SLC6A4
SCHEMBL12920990 0.72 SLC6A4 (0.38) SLC6A4
SCHEMBL27829831 0.72 GAA (0.35)
SCHEMBL27848398 0.72 GAA (0.35)

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-2020011147-A1 RORγ ANTAGONIST AND APPLICATION THEREOF IN MEDICINE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2020-01-16 WO disclosed