SCHEMBL8201119

SCHEMBL8201119

C(OCC1CO1)C1CO1.CC(O)COCCOCCO

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 5/20 0.38
TDP1 Q9NUW8 2/20 0.38
MAPK1 P28482 2/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
PDK1 Q15118 1/20 0.31
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
SCHEMBL8199161 0.97 TSHR (0.42) TSHRHSD17B10SMN1; SMN2ALDH1A1TDP1
Propylene Glycol SCHEMBL28907180 0.87 TSHR (0.47) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL9747524 0.84 SMN1; SMN2 (0.41) TSHRHSD17B10SMN1; SMN2ALDH1A1TDP1
SCHEMBL2367662 0.84 TSHR (0.45) TSHRHSD17B10SMN1; SMN2ALDH1A1TDP1
Tetraethylene Glycol SCHEMBL55602 0.84 TSHR (0.54) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
Triethylene Glycol SCHEMBL17007808 0.84 TSHR (0.54) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
Triethylene Glycol SCHEMBL54012 0.84 TSHR (0.54) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
Triethylene Glycol SCHEMBL27622048 0.83 TSHR (0.48) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL16039188 0.82
SCHEMBL16115060 0.82

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
US-6019908-A ACTIVE HYDROGEN COMPOUND IS REACTED WITH GLYCIDYL ETHERS TOGETHER WITH ETHYLENE OXIDES TO OBTAIN A POLYETHER COMPOUND AND THE POLYETHER COMPOUND IS REACTED WITH A COMPOUND HAVING A POLYMERIZABLE FUNCTIONAL GROUP; CROSSLINKING DAI-ICHI KOGYO SEIYAKU, CO., LTD. (JP) 2000-02-01 US disclosed
EP-0460876-B1 Ion-conductive polymer electrolyte DAI ICHI KOGYO SEIYAKU CO LTD (JP) 1995-10-25 EP disclosed
EP-0392839-B1 Ion-conductive polymer electrolyte DAI ICHI KOGYO SEIYAKU CO LTD (JP) 1995-07-12 EP disclosed
EP-0425255-B1 Ion-conductive polymer electrolyte DAI ICHI KOGYO SEIYAKU CO LTD (JP) 1995-04-26 EP disclosed
US-5159001-A Crosslinked polyether and soluble salt DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1992-10-27 US disclosed
US-5116541-A Polyether DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1992-05-26 US disclosed
US-5098589-A Modified polyether polymers or polyepoxides DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1992-03-24 US disclosed
EP-0460876-A1 Ion-conductive polymer electrolyte DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1991-12-11 EP disclosed
EP-0425255-A2 Ion-conductive polymer electrolyte DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1991-05-02 EP disclosed
EP-0392839-A2 Ion-conductive polymer electrolyte DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1990-10-17 EP disclosed