SCHEMBL3255607

SCHEMBL3255607

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ADRB2 P07550 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 8/20 0.40
HPGD P15428 6/20 0.40
POLB P06746 5/20 0.39
TDP1 Q9NUW8 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TP53 P04637 2/20 0.39
ALDH1A1 P00352 3/20 0.37
USP2 O75604 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MAPT P10636 6/20 0.36
GAA P10253 1/20 0.36
CYP2C19 P33261 1/20 0.36
ESR1 P03372 1/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL3247255 0.88 RXFP1 (0.42) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3246010 0.87 KDM4E (0.40) KDM4EKMT2AMEN1HSD17B10HPGD
SCHEMBL4155199 0.84 TP53 (0.37) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3248232 0.84 HSD17B10 (0.47) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3248316 0.83 MAPT (0.38) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3253542 0.83 ALOX5AP (0.36) KMT2AMEN1HSD17B10HPGD
SCHEMBL3250948 0.82 KDM4E (0.46) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3245366 0.82 KDM4E (0.39) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3251058 0.82 MAPT (0.37) KDM4EKMT2AMEN1ADRB2RECQL
SCHEMBL3251059 0.82 MAPT (0.37) KDM4EKMT2AMEN1ADRB2RECQL

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