SCHEMBL8087908

SCHEMBL8087908

CCO[Si](CC)(OCC)OCCC1=CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
RAB9A P51151 2/20 0.40
ALOX15 P16050 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
KDM4E B2RXH2 1/20 0.34
RECQL P46063 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL107686 0.82 ALDH1A1 (0.42) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL5408284 0.78 ALDH1A1 (0.38) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL4847714 0.78 PKM (0.39) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL4325254 0.77 JAK2 (0.34) ALDH1A1RAB9ANPC1
SCHEMBL9451069 0.76 ALDH1A1 (0.45) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL109570 0.76 ALDH1A1 (0.40) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL3893404 0.74 ALDH1A1 (0.41) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL3886793 0.74 ALDH1A1 (0.41) ALDH1A1RAB9AALOX15SMN1; SMN2GAA
SCHEMBL5398213 0.73 ALDH1A1 (0.33) ALDH1A1RAB9AALOX15
SCHEMBL19277217 0.72 ALDH1A1 (0.47) ALDH1A1RAB9AALOX15SMN1; SMN2GAA

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
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed