SCHEMBL731669

SCHEMBL731669

C=CCC(=CCC=CN)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABAT P80404 1/20 0.31
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 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
SCHEMBL729428 0.85
SCHEMBL729720 0.82 KDM4E (0.30)
SCHEMBL462909 0.81 TSHR (0.34) ABAT
SCHEMBL462908 0.81 TSHR (0.34) ABAT
SCHEMBL28288996 0.78 KDM4E (0.31)
Propane SCHEMBL15303565 0.76 GRIK1 (0.32) GRIK1GRIK2
SCHEMBL7660541 0.74
SCHEMBL45772 0.74
Butane SCHEMBL10765613 0.74 GRIK1 (0.33) GRIK1GRIK2
SCHEMBL5133417 0.71 GRIK1 (0.47) ABATGRIK1GRIK2

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-8136676-B2 a membrane or fibers composed of or coated with methoxyethyl methacrylate/2-/-di(ethylene glycol)ethyl ether methacrylate-2-(diethylamino)ethyl methacrylate terpolymer for the selective removal, reduction or separation of white blood cells and/or platelets from blood by passing blood through the medium UNIVERSITY OF SOUTHAMPTON (GB) 2012-03-20 US disclosed
US-20080190843-A1 Polymers Useful as Medical Materials UNIVERSITY OF SOUTHAMPTON (GB) 2008-08-14 US disclosed