SCHEMBL8945486

SCHEMBL8945486

ICCCOC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
NAAA Q02083 1/20 0.36

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
SCHEMBL5754557 0.85 NPC1 (0.52) NPC1NAAA
SCHEMBL9011558 0.85 NPC1 (0.56) NPC1NAAA
SCHEMBL9011682 0.82 NPC1 (0.54) NPC1NAAA
SCHEMBL262805 0.82 NPC1 (0.54) NPC1NAAA
SCHEMBL6926390 0.82
SCHEMBL9011906 0.82 NPC1 (0.54) NPC1NAAA
SCHEMBL9011791 0.82 NPC1 (0.54) NPC1NAAA
SCHEMBL1260397 0.81 NPC1 (0.48) NPC1NAAA
SCHEMBL3345124 0.81 NPC1 (0.48) NPC1NAAA
SCHEMBL2513245 0.79 NPC1 (0.50) NPC1NAAA

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
US-5510375-A VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS WARNER-LAMBERT COMPANY (US) 1996-04-23 US disclosed