SCHEMBL20344484

SCHEMBL20344484

CC(C)CCc1cc(C(F)(F)F)ccc1NC=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.36
XPO1 O14980 1/20 0.36
MAPK1 P28482 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNH2 Q12809 3/20 0.34
TMEM97 Q5BJF2 3/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
CETP P11597 1/20 0.33
GAA P10253 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
SCHEMBL19980298 0.77 MAPK1 (0.38) MAPK1MAPTKCNH2TMEM97SLC6A4
SCHEMBL23188990 0.74 TSHR (0.38) MAPK1MAPTNPSR1SLC6A2SLC6A4
SCHEMBL14131082 0.73 FFAR4 (0.43) KCNH2TMEM97SLC6A2SLC6A4MEN1
SCHEMBL20344524 0.73 KIF11 (0.40) MAPK1MAPTKCNH2SLC6A4MEN1
SCHEMBL18570980 0.72 SLC6A2 (0.39) KCNH2TMEM97SLC6A2SLC6A4ALDH1A1
SCHEMBL28173592 0.71 SLC6A4 (0.51) SLC6A2SLC6A4TRPV1CETPGAA
SCHEMBL10238280 0.69 ALDH1A1 (0.50) RXFP1MAPTMEN1KMT2ACA1
SCHEMBL21885675 0.69 RXFP1 (0.43) RXFP1MAPK1MAPTNPSR1MEN1
SCHEMBL29643387 0.69 RXFP1 (0.43) RXFP1MAPK1MAPTNPSR1MEN1
SCHEMBL24576209 0.69 RXFP1 (0.40) RXFP1MAPK1MAPTNPSR1MEN1

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
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-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed