SCHEMBL20726418

SCHEMBL20726418

C/C(O)=C1\C(=O)Nc2cc(Cl)c(-c3ccc(N(C)C4CC4)cc3)cc21

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 6/20 0.32
PRKAG1 P54619 6/20 0.32
PRKAA2 P54646 6/20 0.32
PRKAA1 Q13131 6/20 0.32
PRKAG3 Q9UGI9 6/20 0.32
PRKAG2 Q9UGJ0 6/20 0.32
PRKAB1 Q9Y478 6/20 0.32
CHEK1 O14757 2/20 0.31
BRD4 O60885 1/20 0.31
CES1 P23141 1/20 0.31
DHODH Q02127 1/20 0.30
CFTR P13569 1/20 0.30

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
SCHEMBL20726347 0.86 DHODH (0.38) PRKAG1PRKAA1PRKAB1CHEK1BRD4
SCHEMBL20726493 0.80 CHEK1 (0.32) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL16824360 0.80 PRKAB1 (0.34) PRKAG1PRKAA2PRKAA1PRKAG2PRKAB1
SCHEMBL30629981 0.80 PRKAB1 (0.34) PRKAG1PRKAA2PRKAA1PRKAG2PRKAB1
SCHEMBL16824362 0.80 PRKAB1 (0.34) PRKAG1PRKAA2PRKAA1PRKAG2PRKAB1
SCHEMBL20726374 0.78 PRKAB2 (0.45) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL20726469 0.77 PRKAB2 (0.52) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL20726527 0.77 USP2 (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL20726400 0.77 PRKAB2 (0.49) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL20726426 0.77 PRKAB2 (0.52) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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-3083611-B1 OXINDOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE IN THE TREATMENT OF AMPK-RELATED DISEASES SANOFI SA (FR) 2019-02-13 EP disclosed