SCHEMBL3249243

SCHEMBL3249243

CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3[nH]c(=O)c4[nH]cc(C(=O)O)c4c3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
RAB9A P51151 1/20 0.55
PKM P14618 2/20 0.50
BRD4 O60885 4/20 0.47
MAPT P10636 1/20 0.46
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44
HTR6 P50406 1/20 0.43

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
SCHEMBL3251041 0.90 MAPT (0.50) MEN1KMT2ARAB9ABRD4MAPT
SCHEMBL3246043 0.90 BRD4 (0.48) MEN1KMT2ARAB9APKMBRD4
SCHEMBL3249236 0.89 BRD4 (0.60) BRD4MAPTHTR6
SCHEMBL3245598 0.88 BRD4 (0.48) MEN1KMT2ARAB9ABRD4HTR6
SCHEMBL3248975 0.88 POLB (0.49) MEN1KMT2APKMBRD4GAA
SCHEMBL3248780 0.88 BRD4 (0.58) PKMBRD4MAPTGAAHTR6
SCHEMBL3249171 0.88 CHEK1 (0.51) KMT2ABRD4LMNASMN1; SMN2ALOX15
SCHEMBL3242688 0.88 BRD4 (0.60) MEN1KMT2ABRD4MAPTHTR6
SCHEMBL3255249 0.88 BRD4 (0.60) MEN1KMT2APKMBRD4MAPT
SCHEMBL3254000 0.87 LMNA (0.53) MEN1KMT2ARAB9APKMBRD4

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 4 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-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