SCHEMBL4967007

SCHEMBL4967007

Cc1c(C#N)c2ccccn2c1OC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
KDM4E B2RXH2 9/20 0.49
GAA P10253 3/20 0.49
GLA P06280 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 7/20 0.43
MEN1 O00255 5/20 0.43
MAPK1 P28482 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 5/20 0.42
HTT P42858 3/20 0.42
LMNA P02545 3/20 0.42
NCOA3 Q9Y6Q9 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
PABPC1 P11940 1/20 0.42
CASP3 P42574 1/20 0.42
NCOA1 Q15788 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
STAT3 P40763 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
SCHEMBL4918574 0.80 KDM4E (0.54) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL4910987 0.74 SMN1; SMN2 (0.61) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL3671567 0.71 LMNA (0.55) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL16175964 0.66 KDM4E (1.00) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL3668186 0.66 KDM4E (0.48) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL17331499 0.64 ALDH1A1 (0.48) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL365090 0.63 ALDH1A1 (0.68) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL5737978 0.63 KMT2A (0.63) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL365546 0.63 KMT2A (0.64) ALDH1A1KDM4EGAAGLAHPGD
SCHEMBL7590158 0.63 CYP11B2 (0.56) ALDH1A1KDM4EGAAGLAHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778685-B1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SANOL ARZNEI SCHWARZ GMBH (DE) 2008-03-26 EP disclosed
EP-1778685-A1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SCHWARZ PHARMA AG (DE) 2007-05-02 EP disclosed
WO-2006015737-A1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SCHWARZ PHARMA AG (DE) 2006-02-16 WO disclosed