SCHEMBL20103697

SCHEMBL20103697

CCN(C=O)C1CCC(C)(C)CC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 6/20 0.64
ADH1C P00326 5/20 0.64
ADH4 P08319 1/20 0.44

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
SCHEMBL967295 0.84
SCHEMBL969252 0.82
SCHEMBL967215 0.80 ADH1A (0.95) ADH1AADH1CADH4
SCHEMBL9660584 0.78 ADH1A (1.00) ADH1AADH1CADH4
SCHEMBL10948024 0.78 ADH1A (1.00) ADH1AADH1CADH4
SCHEMBL966676 0.78 ADH1A (1.00) ADH1AADH1CADH4
SCHEMBL9462480 0.78 ADH1A (1.00) ADH1AADH1CADH4
SCHEMBL3955640 0.75 ADH1A (0.64) ADH1AADH1CADH4
SCHEMBL18469922 0.73 ADH1A (0.62) ADH1AADH1CADH4
SCHEMBL18573994 0.71 SLC6A4 (0.41) ADH1AADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110810-B1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LTD (JP) 2018-05-02 EP disclosed