SCHEMBL3248331

SCHEMBL3248331

CN(CC(=O)O)S(=O)(=O)c1ccc2[nH]c(=O)c3[nH]cc(C(=O)O)c3c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.60
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 1/20 0.44
ADRB2 P07550 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 5/20 0.44
HSD17B10 Q99714 3/20 0.44
TP53 P04637 1/20 0.40
MAPT P10636 6/20 0.39
LMNA P02545 4/20 0.39
PLAU P00749 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GLA P06280 1/20 0.38
THRB P10828 1/20 0.38
GAA P10253 2/20 0.37

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
SCHEMBL3241909 0.92 KDM4E (0.50) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3250948 0.89 KDM4E (0.46) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3248232 0.88 HSD17B10 (0.47) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3246046 0.88 KDM4E (0.46) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3245166 0.87 KDM4E (0.44) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3250315 0.87 KDM4E (0.46) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3251841 0.87 MAPT (0.51) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3256134 0.87 KDM4E (0.53) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3251033 0.86 KDM4E (0.43) KDM4EALDH1A1MEN1ADRB2RECQL
SCHEMBL3241807 0.86 KDM4E (0.48) KDM4EALDH1A1MEN1ADRB2RECQL

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