SCHEMBL11284017

SCHEMBL11284017

CCCCCCCCC1CCCC1OC(=O)CCCCCC

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.58
PRKCA P17252 6/20 0.48
ALOX5 P09917 1/20 0.44
DGKA P23743 1/20 0.42
LMNA P02545 2/20 0.40

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
SCHEMBL3191720 0.87 NAAA (0.69) NAAAPRKCADGKALMNA
SCHEMBL27114259 0.87 NAAA (0.69) NAAAPRKCADGKALMNA
SCHEMBL3191726 0.87 NAAA (0.69) NAAAPRKCADGKALMNA
SCHEMBL27622693 0.86 NAAA (0.49) NAAAPRKCAALOX5DGKA
SCHEMBL28014438 0.85 NAAA (0.48) NAAAPRKCAALOX5DGKA
SCHEMBL9861645 0.84 NAAA (0.74) NAAAPRKCADGKALMNA
SCHEMBL9861650 0.84 NAAA (0.74) NAAAPRKCADGKALMNA
SCHEMBL3179079 0.84 NAAA (0.74) NAAAPRKCADGKALMNA
SCHEMBL3171692 0.84 NAAA (0.74) NAAAPRKCADGKALMNA
SCHEMBL3179072 0.84 NAAA (0.74) NAAAPRKCADGKALMNA

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-4309441-A HYPOTENSIVE AGENTS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-01-05 US disclosed