SCHEMBL3244469

SCHEMBL3244469

COc1ccc2c(c1)[nH]c(=O)c1[nH]cc(C(=O)O)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 4/20 0.52
POLB P06746 2/20 0.52
GAA P10253 2/20 0.52
CDK4 P11802 3/20 0.49
CCND1 P24385 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 1/20 0.48
TUBB1 Q9H4B7 2/20 0.47
HPGD P15428 2/20 0.46
MEN1 O00255 1/20 0.46
HCRTR1 O43613 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CLK1 P49759 2/20 0.46
CDK5 Q00535 2/20 0.46
DYRK1A Q13627 2/20 0.46
CDK5R1 Q15078 2/20 0.46

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
SCHEMBL3254865 0.85 ALDH1A1 (0.47) KDM4EALDH1A1GAACDK4CCND1
SCHEMBL3249118 0.83 KDM4E (0.51) KDM4EALDH1A1POLBGAATDP1
SCHEMBL3249318 0.82 RET (0.48) KDM4EALDH1A1POLBGAATDP1
SCHEMBL3244302 0.81 F7 (0.52) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL3245636 0.81 KDM4E (0.51) KDM4EALDH1A1CDK4CCND1HPGD
SCHEMBL4153199 0.80 GPR17 (0.54) KDM4EALDH1A1POLBCDK4CCND1
SCHEMBL3241683 0.78 KDM4E (0.43) KDM4EALDH1A1POLBGAATDP1
SCHEMBL30075344 0.78 MAPT (0.73) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL590922 0.78 MAPT (0.73) KDM4EALDH1A1GAAL3MBTL1MAPT
SCHEMBL3247782 0.77 KDM4E (0.54) KDM4EALDH1A1GAATDP1MAPT

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