SCHEMBL9547101

SCHEMBL9547101

O=C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC1CO1)OCC1CO1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.60
LMNA P02545 1/20 0.58
POLB P06746 1/20 0.58
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL1714569 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL9547082 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL471820 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL936727 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL471890 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL2575401 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL9546992 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL471871 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL1715123 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53
SCHEMBL9547014 1.00 MGLL (0.60) MGLLLMNAPOLBALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276327-B1 RESIN COMPOSITION AND PROCESS FOR ITS PREPARATION TORAY INDUSTRIES, INC. (JP) 1993-04-07 EP disclosed
US-5017650-A Molding materials TORAY INDUSTRIES, INC. (JP) 1991-05-21 US disclosed
US-5006610-A Improved mechanical properties and solvent resistance TORAY INDUSTRIES, INC. (JP) 1991-04-09 US disclosed
EP-0276327-A1 RESIN COMPOSITION AND PROCESS FOR ITS PREPARATION TORAY INDUSTRIES, INC. (JP) 1988-08-03 EP disclosed