SCHEMBL11879110

SCHEMBL11879110

OCCOCCON=C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 3/20 0.39
MAPK1 P28482 1/20 0.39
FAAH O00519 1/20 0.34
ABHD16A O95870 1/20 0.34
PLA2G7 Q13093 1/20 0.34
NCEH1 Q6PIU2 1/20 0.34
DAGLB Q8NCG7 1/20 0.34
DAGLA Q9Y4D2 1/20 0.34
CASP1 P29466 1/20 0.33
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 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
SCHEMBL11878543 1.00 MEN1 (0.42) MEN1KMT2ATSHRMAPK1FAAH
SCHEMBL11127644 0.88 TSHR (0.39) MEN1KMT2ATSHRFAAHABHD16A
SCHEMBL13922050 0.86 MEN1 (0.35) MEN1KMT2ATSHRFAAHABHD16A
SCHEMBL10298194 0.77 MEN1 (0.42) MEN1KMT2ATSHRMAPK1CASP1
SCHEMBL10298191 0.74 TSHR (0.40) MEN1KMT2ATSHRMAPK1CASP1
Tetraethylene Glycol SCHEMBL17555610 0.73 MEN1 (0.79) MEN1KMT2ATSHRMAPK1CASP1
Triethylene Glycol SCHEMBL27787404 0.73 MEN1 (0.79) MEN1KMT2ATSHRMAPK1CASP1
SCHEMBL10298192 0.72 TSHR (0.42) MEN1KMT2ATSHRMAPK1CASP1
SCHEMBL7540680 0.71 CHRM2 (0.36) MEN1KMT2ATSHRFAAHABHD16A
Triethylene Glycol SCHEMBL22685881 0.71 MEN1 (0.73) MEN1KMT2ATSHRMAPK1THRB

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-3965177-A POLYOXYALKYLATED ALKANONES OR ALKANAL OXIMES, BASIC NITROGEN CATALYST TEXACO INC. (US) 1976-06-22 US disclosed