SCHEMBL6545307

SCHEMBL6545307

C=C(CC=C(C)C(=O)OCC1CO1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MGLL Q99685 3/20 0.33

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
SCHEMBL7592646 0.92 ALDH1A1 (0.68) ALDH1A1TP53CYP3A4MGLL
SCHEMBL3069536 0.90 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4MGLL
SCHEMBL20503771 0.83 ALDH1A1 (0.57) ALDH1A1TP53CYP3A4MGLL
Methacrylic Acid SCHEMBL27487270 0.83 ALDH1A1 (0.62) ALDH1A1TP53CYP3A4MGLL
SCHEMBL7967625 0.82 ALDH1A1 (0.61) ALDH1A1TP53CYP3A4MGLL
Methacrylic Acid SCHEMBL27750574 0.81 ALDH1A1 (0.68) ALDH1A1TP53CYP3A4MGLL
SCHEMBL3460340 0.81 ALDH1A1 (0.54) ALDH1A1TP53CYP3A4MGLL
SCHEMBL4859260 0.81 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4
SCHEMBL11323687 0.80 ALDH1A1 (0.58) ALDH1A1TP53CYP3A4
1,1-Dichloroethene SCHEMBL5271328 0.80 ALDH1A1 (0.55) ALDH1A1TP53CYP3A4

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-1377631-A1 SOLID POLYMETHYLMETHACRYLATE SURFACE MATERIAL E.I. DUPONT DE NEMOURS AND COMPANY (US) 2004-01-07 EP disclosed
US-6476100-B2 BUILDING MATERIALS, COUNTERTOPS; HEAT RESISTANCE E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-05 US disclosed
US-20020137829-A1 Solid surface materials prepared from extrudable acrylic composites DUPONT SAFETY & CONSTRUCTION, INC. 2002-09-26 US disclosed
WO-2002062883-A1 SOLID POLYMETHYLMETHACRYLATE SURFACE MATERIAL E.I. DUPONT DE NEMOURS AND COMPANY (US) 2002-08-15 WO disclosed