SCHEMBL19980164

SCHEMBL19980164

C=C/C=C(\C=C(/CCCC)C(=O)OC1CCCC1)OC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.43
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
EPHX1 P07099 1/20 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
SCHEMBL27768655 0.72 NAAA (0.65) NAAAALDH1A1HTTEPHX1
SCHEMBL13972986 0.71 CA12 (0.31) EPHX1
SCHEMBL4455041 0.70 NAAA (0.38) NAAAALDH1A1HTT
SCHEMBL29117609 0.70 NAAA (0.57) NAAAALDH1A1HTTEPHX1
SCHEMBL9009690 0.70 NAAA (0.57) NAAAALDH1A1HTTEPHX1
SCHEMBL29117608 0.68 NAAA (0.50) NAAAALDH1A1HTTEPHX1
SCHEMBL4743688 0.68 NAAA (0.58) NAAAALDH1A1HTTEPHX1
SCHEMBL27593606 0.68 EPHX1 (0.41) NAAAHTTEPHX1
SCHEMBL4978860 0.67 NAAA (0.86) NAAAALDH1A1HTTEPHX1
SCHEMBL28473788 0.67 NAAA (0.63) NAAAALDH1A1HTTEPHX1

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
EP-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 EP disclosed
EP-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 EP disclosed
EP-3508484-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-07-10 EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 EP disclosed