SCHEMBL3249044

SCHEMBL3249044

CS(=O)(=O)c1cccc(-c2cc3c(cc2Cl)[nH]c(=O)c2[nH]cc(C(=O)O)c23)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 19/20 0.48
PRKAA1 Q13131 19/20 0.48
PRKAB1 Q9Y478 19/20 0.48
PRKAB2 O43741 17/20 0.48
PRKAA2 P54646 17/20 0.48
PRKAG3 Q9UGI9 17/20 0.48
PRKAG2 Q9UGJ0 17/20 0.48
FASN P49327 1/20 0.48

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
SCHEMBL3252420 0.88 FASN (0.44) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL3242761 0.85 CAMKK2 (0.46) FASN
SCHEMBL4159323 0.85 FASN (0.45) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL3241835 0.81 FASN (0.43) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL13950957 0.81 FASN (0.44) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
Propionic Acid SCHEMBL4159324 0.79 FASN (0.48) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL4172113 0.76 CSNK2A2 (0.40) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL3241482 0.76 WEE1 (0.39) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL3248872 0.76 WEE1 (0.41)
SCHEMBL3245633 0.74 PRKAB2 (0.46) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
EP-1899335-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2008-03-19 EP claimed
WO-2007003611-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2007-01-11 WO claimed
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP disclosed
EP-1899335-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2008-03-19 EP disclosed
WO-2007003611-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2007-01-11 WO disclosed