SCHEMBL11350171

SCHEMBL11350171

CCCCCCCCCCSCCOCCOCCOCCO

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
THRB P10828 2/20 0.64
MAPT P10636 2/20 0.64
HTT P42858 1/20 0.64
TSHR P16473 3/20 0.54
LMNA P02545 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
USP2 O75604 1/20 0.44
CYP3A4 P08684 1/20 0.44
CASP1 P29466 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SLCO1B3 Q9NPD5 1/20 0.44
SLCO1B1 Q9Y6L6 1/20 0.44
CES2 O00748 3/20 0.41
HSD17B10 Q99714 2/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL11517971 1.00 MEN1 (0.64) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11517767 1.00 MEN1 (0.64) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11474042 0.98 MEN1 (0.61) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11490363 0.90 TSHR (0.60) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11852318 0.90 THRB (0.46) MEN1KMT2ATHRBMAPTHTT
SCHEMBL10931986 0.89 MEN1 (0.53) MEN1KMT2ATHRBMAPTHTT
SCHEMBL29462497 0.88 CES2 (0.45) MEN1KMT2ATHRBMAPTHTT
SCHEMBL7602668 0.88 CES2 (0.45) MEN1KMT2ATHRBMAPTHTT
SCHEMBL5382481 0.88 CES2 (0.45) MEN1KMT2ATHRBMAPTHTT
Di(Hydroxyethyl)Ether SCHEMBL28263629 0.86 TSHR (0.65) MEN1KMT2ATHRBMAPTHTT

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-4243563-A EMULSIFIERS, SOIL EROSION CHEVRON RESEARCH COMPANY (US) 1981-01-06 US disclosed