SCHEMBL9320841

SCHEMBL9320841

OCCOCCOCCOC(=S)S

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 4/20 0.50
MAPK1 P28482 1/20 0.50
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 2/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 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
Triethylene Glycol SCHEMBL9320833 0.84 ALDH1A1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL9319355 0.84
SCHEMBL11513161 0.81
Triethylene Glycol SCHEMBL31544292 0.81 MEN1 (0.65) MEN1KMT2ATSHRMAPK1THRB
Triethylene Glycol SCHEMBL9320835 0.81 MEN1 (0.65) MEN1KMT2ATSHRMAPK1THRB
Hexaethylene Glycol SCHEMBL3093371 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL9778619 0.78 ALDH1A1 (0.48) MEN1KMT2ATSHRTHRBALDH1A1
SCHEMBL30175055 0.77 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL10353558 0.77 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL9778768 0.76 ALDH1A1 (0.46) MEN1KMT2ATSHRTHRBALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0383811-B1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES CPC INTERNATIONAL INC (US) 1994-01-12 EP claimed
EP-0383811-A4 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES 1990-10-24 EP claimed
EP-0383811-A1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES. CPC INTERNATIONAL INC (US) 1990-08-29 EP claimed
WO-1989003383-A1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES CPC INTERNATIONAL INC. (US) 1989-04-20 WO claimed
US-4806149-A Method for regulating plant growth using xanthates CPC INTERNATIONAL INC. (US) 1989-02-21 US claimed
EP-0383811-B1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES CPC INTERNATIONAL INC (US) 1994-01-12 EP disclosed
EP-0383811-A4 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES 1990-10-24 EP disclosed
EP-0383811-A1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES. CPC INTERNATIONAL INC (US) 1990-08-29 EP disclosed
WO-1989003383-A1 METHOD FOR REGULATING PLANT GROWTH USING XANTHATES CPC INTERNATIONAL INC. (US) 1989-04-20 WO disclosed
US-4806149-A Method for regulating plant growth using xanthates CPC INTERNATIONAL INC. (US) 1989-02-21 US disclosed