SCHEMBL3250653

SCHEMBL3250653

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.57
PKM P14618 3/20 0.50
BRAF P15056 1/20 0.50
PDE3A Q14432 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
GAA P10253 2/20 0.43
AR P10275 1/20 0.43
HSD17B10 Q99714 3/20 0.43
HPGD P15428 2/20 0.43
MIF P14174 1/20 0.43
BACE1 P56817 1/20 0.42
NAPEPLD Q6IQ20 1/20 0.41
USP2 O75604 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PTPN7 P35236 1/20 0.41
GFER P55789 1/20 0.41
BRD4 O60885 1/20 0.41
TP53 P04637 1/20 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
SCHEMBL3248975 0.94 POLB (0.49) POLBPKMBRAFMEN1KMT2A
SCHEMBL3244485 0.92 POLB (0.47) POLBPKMBRAFPDE3AKMT2A
SCHEMBL3247955 0.91 PKM (0.54) POLBPKMBRAFPDE3AMEN1
SCHEMBL3254470 0.91 PKM (0.53) POLBPKMBRAFPDE3AGAA
SCHEMBL3248608 0.90 POLB (0.46) POLBPKMBRAFPDE3AMEN1
SCHEMBL3251303 0.90 PDE3A (0.45) POLBPKMBRAFPDE3AGAA
SCHEMBL3251084 0.90 MAPT (0.50) POLBPKMBRAFPDE3AMEN1
SCHEMBL3249991 0.90 BRD4 (0.50) POLBPKMPDE3AGAAAR
SCHEMBL3251476 0.87 BRD4 (0.48) POLBKMT2ABACE1MAPTBRD4
SCHEMBL3249048 0.87 POLB (0.54) POLBMEN1KMT2AGAAHSD17B10

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