SCHEMBL4073186

SCHEMBL4073186

COCCNC(=O)CN1C(=O)C(C(N)=O)Cc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 2/20 0.60
GAA P10253 1/20 0.60
MAPK1 P28482 1/20 0.48
KMT2A Q03164 2/20 0.46
THRB P10828 1/20 0.46
NPC1 O15118 1/20 0.46
TSHR P16473 1/20 0.46
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
PYGL P06737 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL4073194 0.87 KDM4E (0.62) KDM4EALDH1A1GAAMAPK1KMT2A
SCHEMBL4067884 0.87 PYGL (0.50) KDM4EALDH1A1GAAMAPK1TSHR
SCHEMBL4066125 0.85 LMNA (0.42) KDM4EALDH1A1GAAMAPK1KMT2A
SCHEMBL4065818 0.78 KDM4E (0.53) KDM4EALDH1A1GAAMAPK1KMT2A
SCHEMBL4073287 0.77 PYGL (0.39) ALDH1A1GAATSHRPYGL
SCHEMBL4064789 0.76 POLB (0.47) ALDH1A1TSHRPYGL
SCHEMBL4073290 0.76 AADAT (0.48) KDM4EALDH1A1GAATHRBNPC1
SCHEMBL4068434 0.74 TSHR (0.44) ALDH1A1GAAKMT2ATSHRSMN1; SMN2
SCHEMBL4069562 0.74 CHRM2 (0.48) KDM4EALDH1A1KMT2ATHRBPYGL
SCHEMBL4064970 0.73 PYGL (0.44) KDM4EALDH1A1KMT2ATSHRPYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1819332-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LTD (GB) 2009-03-11 EP disclosed