SCHEMBL8931132

SCHEMBL8931132

OCC(CO)OCC1COC(CO)CO1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
ALDH1A1 P00352 3/20 0.33
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.31
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
SCHEMBL27397026 0.92 TSHR (0.39) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL28066490 0.80 TSHR (0.34) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL4740030 0.80 ALDH1A1 (0.39) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL11263631 0.80 ALDH1A1 (0.36) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL42453 0.78 ALDH1A1 (0.45) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL1638716 0.77
SCHEMBL22443175 0.77 ALDH1A1 (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL3416030 0.77 ALDH1A1 (0.44) TSHRALDH1A1TP53CYP3A4MAPK1
Ethylene SCHEMBL21799138 0.76 ALDH1A1 (0.42) TSHRALDH1A1MAPK1SMN1; SMN2
SCHEMBL16134386 0.76 ALDH1A1 (0.37) TSHRALDH1A1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5635588-A Polymerisation of glycerol using a zeolite catalyst UNICHEMA CHEMIE B.V. (NL) 1997-06-03 US disclosed
EP-0683800-B1 POLYMERIZATION OF GLYCEROL USING A ZEOLITE CATALYST UNICHEMA CHEMIE BV (NL) 1997-01-02 EP disclosed