SCHEMBL3247955

SCHEMBL3247955

O=C(O)c1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)Nc4ccc(O)cc4)cc3c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.54
GAA P10253 1/20 0.54
AR P10275 1/20 0.54
PDE3A Q14432 1/20 0.46
POLB P06746 6/20 0.45
GFER P55789 1/20 0.43
NAPEPLD Q6IQ20 1/20 0.42
BRD4 O60885 2/20 0.42
STAT3 P40763 1/20 0.41
TDP1 Q9NUW8 4/20 0.41
MAPT P10636 4/20 0.41
HSD17B10 Q99714 3/20 0.41
USP2 O75604 2/20 0.41
TP53 P04637 2/20 0.41
ALOX15 P16050 2/20 0.41
BRAF P15056 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
ALOX12 P18054 2/20 0.41

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
SCHEMBL3254470 0.92 PKM (0.53) PKMGAAARPDE3APOLB
SCHEMBL3250653 0.91 POLB (0.57) PKMGAAARPDE3APOLB
SCHEMBL3249991 0.91 BRD4 (0.50) PKMGAAARPDE3APOLB
SCHEMBL3251084 0.91 MAPT (0.50) PKMGAAARPDE3APOLB
SCHEMBL3251303 0.91 PDE3A (0.45) PKMGAAARPDE3APOLB
SCHEMBL3242970 0.89 POLB (0.44) PKMGAAARPDE3APOLB
SCHEMBL3249048 0.88 POLB (0.54) GAAPOLBGFERBRD4TDP1
SCHEMBL3248608 0.87 POLB (0.46) PKMGAAARPDE3APOLB
SCHEMBL3244485 0.87 POLB (0.47) PKMGAAARPDE3APOLB
SCHEMBL3252031 0.86 PKM (0.53) PKMGAAARPOLBGFER

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