SCHEMBL798471

SCHEMBL798471

O=CN[C@@H]1CCCC[C@H]1NC=O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 9/20 0.60
ADH1C P00326 6/20 0.60
ADH1B P00325 5/20 0.60
ADH7 P40394 3/20 0.60
ADH4 P08319 3/20 0.57
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 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
SCHEMBL15314039 1.00 ADH1A (0.60) ADH1AADH1CADH1BADH7ADH4
SCHEMBL798497 0.94 ADH1A (0.60) ADH1AADH1CADH1BADH7ADH4
SCHEMBL13572438 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL21032785 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL4925352 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL4912507 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL14594135 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL1766842 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL16204593 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4
SCHEMBL8408829 0.82 ADH1B (0.48) ADH1AADH1CADH1BADH7ADH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673998-B2 Polymer compositions with improved cold flow BRIDGESTONE CORPORATION (JP) 2014-03-18 US claimed
US-20120071583-A1 POLYMER COMPOSITIONS WITH IMPROVED COLD FLOW BRIDGESTONE CORPORATION (JP) 2012-03-22 US claimed
US-8673998-B2 Polymer compositions with improved cold flow BRIDGESTONE CORPORATION (JP) 2014-03-18 US disclosed
US-20120071583-A1 POLYMER COMPOSITIONS WITH IMPROVED COLD FLOW BRIDGESTONE CORPORATION (JP) 2012-03-22 US disclosed
US-20070060658-A1 STABILIZATION OF ORGANOGELS AND HYDROGELS BY AZIDE-ALKYNE [3+2] CYCLOADDITION THE SCRIPPS RESEARCH INSTITUTE 2007-03-15 US disclosed