SCHEMBL28063124

SCHEMBL28063124

C1CCC(C2CCCC2)C1.CCCCC(=O)O[SiH2]CCC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.45
LMNA P02545 2/20 0.35
EPHX2 P34913 1/20 0.35
GNAI3 P08754 2/20 0.34
GNAO1 P09471 2/20 0.34
GNAI1 P63096 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CCR1 P32246 1/20 0.33
CCR2 P41597 1/20 0.33
DGKA P23743 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
SCHEMBL28063224 0.90 ALDH1A1 (0.38) NAAAALDH1A1CCR1CCR2
SCHEMBL28063263 0.86 CES1 (0.42) LMNAALDH1A1KMT2ADGKA
SCHEMBL28063122 0.79 NAAA (0.38) NAAALMNAEPHX2SMN1; SMN2
SCHEMBL28063223 0.75 SMN1; SMN2 (0.35) NAAASMN1; SMN2
SCHEMBL6658190 0.75 DGKA (0.42) NAAALMNAALDH1A1KMT2ADGKA
SCHEMBL27908283 0.75 DGKA (0.53) NAAAEPHX2ALDH1A1DGKA
SCHEMBL28063132 0.74 ALDH1A1 (0.50) LMNAALDH1A1DGKA
SCHEMBL6663763 0.72 DGKA (0.48) NAAALMNAALDH1A1KMT2ADGKA
SCHEMBL6662620 0.72 DGKA (0.48) NAAALMNAALDH1A1KMT2ADGKA
Hexadecanoic Acid Methyl Ester SCHEMBL28521445 0.71 NAAA (0.62) NAAALMNAEPHX2ALDH1A1KMT2A

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
CN-103391947-B Stabilization of polymers containing hydrolyzable functional groups 株式会社普利司通 2016-08-24 CN disclosed