SCHEMBL3514615

SCHEMBL3514615

C[Si](C)(C)CCCC(C(=O)O)=C(C(=O)O)C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
EPHX1 P07099 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL3514610 1.00 NAAA (0.33) NAAACES2CES1EPHX1SMN1; SMN2
SCHEMBL9709516 0.84 NAAA (0.30) NAAA
SCHEMBL9065479 0.84 EPHX2 (0.30) NAAA
SCHEMBL9709511 0.84 NAAA (0.30) NAAA
SCHEMBL9709148 0.81
SCHEMBL9709344 0.80 CES2 (0.35) NAAACES2CES1EPHX1SMN1; SMN2
SCHEMBL9709355 0.80 CES2 (0.35) NAAACES2CES1EPHX1SMN1; SMN2
SCHEMBL373594 0.75 FNTA (0.43)
SCHEMBL373596 0.75 FNTA (0.43)
SCHEMBL164998 0.74 CES2 (0.39) NAAACES2CES1EPHX1HSD17B10

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-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed