SCHEMBL9620116

SCHEMBL9620116

CCNC=C(CC)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2D6 P10635 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
SCHEMBL23620713 0.82 ADH1B (0.41) FFAR3KDM4ETSHRGRIK1GRIK2
SCHEMBL2124681 0.79 ALOX15 (0.45) KDM4EGRIK1ALDH1A1
SCHEMBL5693455 0.79 TET2 (0.31) KDM4ETSHRGRIK1
SCHEMBL9439701 0.78
SCHEMBL7525961 0.77 HDAC3 (0.30)
SCHEMBL10795506 0.76 FFAR3 (0.35) FFAR3KDM4ETSHRGRIK1GRIK2
SCHEMBL11337166 0.74 FFAR3 (0.33) FFAR3KDM4ETSHRGRIK1GRIK2
SCHEMBL9788226 0.74 ABAT (0.35) FFAR3KDM4ETSHRGRIK1GRIK2
SCHEMBL1648894 0.73
SCHEMBL1648895 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4097277-A Photosensitive member having layer of vinyl carbazole polymer containing antimony chalcogen compound of antimony and sulfur CANON KABUSHIKI KAISHA (JA) 1978-06-27 US claimed
EP-0468991-A1 METHOD OF SEPARATING OIL-IN-WATER EMULSIONS Chemische Fabrik Stockhausen GmbH (DE) 1992-02-05 EP disclosed
WO-1990012633-A1 METHOD OF SEPARATING OIL-IN-WATER EMULSIONS CHEMISCHE FABRIK STOCKHAUSEN GMBH (DE) 1990-11-01 WO disclosed