SCHEMBL8533909

SCHEMBL8533909

C=C(C)COCCCCOCCCCO

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 2/20 0.39
CES2 O00748 2/20 0.38
GAA P10253 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8537833 1.00 MEN1 (0.40) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1576747 0.98 CES2 (0.39) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2790873 0.95 CES2 (0.42) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2793665 0.95 CES2 (0.42) MEN1KMT2ATHRBHTTMAPT
SCHEMBL10031351 0.91 MEN1 (0.40) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1576797 0.91
SCHEMBL871697 0.88 CES2 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL18246477 0.85 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2679547 0.85 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL18245145 0.85 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT

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-5786493-A SILYNATION OF UNSATURATED ALCOHOL, CYCLIZATION AND SOLVOLYSIS HUELS AKTIENGESELLSCHAFT (DE) 1998-07-28 US disclosed