SCHEMBL14224569

SCHEMBL14224569

CCCCCCCCCC(CCCCCCCC=O)C(CCCCCCCCC)CCCCCCCC(=O)OC1CC(C)(C)N(OC(C)=O)C(C)(C)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.40
TSHR P16473 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
PDE4D Q08499 3/20 0.36
PRKCA P17252 1/20 0.35
DGKA P23743 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ESR1 P03372 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL1138659 0.93 NAAA (0.46) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138932 0.86 NAAA (0.52) NAAATSHRKMT2AMEN1GAA
SCHEMBL12660726 0.85 NAAA (0.50) NAAATSHRKMT2AMEN1GAA
SCHEMBL1948723 0.81 TSHR (0.53) NAAATSHRKMT2AMEN1GAA
SCHEMBL14706866 0.81 NAAA (0.45) NAAATSHRDGKA
SCHEMBL14224633 0.81 PDE4D (0.33) NAAAPDE4DPRKCADGKA
SCHEMBL9440185 0.80 TSHR (0.55) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138686 0.79 NAAA (0.55) NAAATSHRKMT2AMEN1GAA
SCHEMBL1138472 0.79 NAAA (0.47) NAAATSHRKMT2AMEN1GAA
SCHEMBL19984802 0.78 NAAA (0.38) NAAATSHRKMT2AMEN1GAA

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-7358365-B2 Process for the controlled increase in the molecular weight of polyethylenes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-04-15 US disclosed