SCHEMBL4072863

SCHEMBL4072863

NC(=O)C1Cc2ccccc2N(CC(=O)N2CCNC(=O)C2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
PARP1 P09874 1/20 0.41
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL4072868 0.88 L3MBTL1 (0.46) L3MBTL1PARP1CHRM2CHRM4CHRM1
SCHEMBL4075040 0.84 CHRM2 (0.54) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4075144 0.84 CHRM2 (0.51) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4066758 0.81 PYGL (0.50) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4066622 0.81 CHRM2 (0.46) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4250746 0.81 MEN1 (0.53) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4064769 0.81 PYGL (0.49) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4069396 0.80 CHRM2 (0.47) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4073094 0.78 CHRM2 (0.49) ALDH1A1MAPTCHRM2CHRM4CHRM1
SCHEMBL4064789 0.74 POLB (0.47) L3MBTL1ALDH1A1TSHRPYGLACE

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