SCHEMBL13110339

SCHEMBL13110339

CCCCCCCCCCCCCCCCC(=O)OC1CC(C)(CC)N(OC(C)=O)C(C)(CC)C1C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.39
PRKCA P17252 6/20 0.38
AR P10275 1/20 0.33
DGKA P23743 1/20 0.33
NLRP3 Q96P20 1/20 0.32

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
SCHEMBL1138765 1.00 NAAA (0.39) NAAAPRKCAARDGKANLRP3
SCHEMBL1138493 0.94 NAAA (0.35) NAAAPRKCAAR
SCHEMBL15385303 0.94 NAAA (0.35) NAAAPRKCAAR
SCHEMBL14224633 0.88 PDE4D (0.33) NAAAPRKCADGKA
SCHEMBL12862569 0.86 CHRM2 (0.32)
SCHEMBL1138758 0.84 TSHR (0.34)
SCHEMBL4804143 0.83 NAAA (0.43) NAAAPRKCAARDGKANLRP3
SCHEMBL4796611 0.83 NAAA (0.43) NAAAPRKCAARDGKANLRP3
SCHEMBL4804134 0.83 NAAA (0.43) NAAAPRKCAARDGKANLRP3
SCHEMBL11535520 0.83 NAAA (0.43) NAAAPRKCAARDGKANLRP3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed