SCHEMBL4073097

SCHEMBL4073097

NC1Cc2ccccc2N(CC(=O)N2CCCC(O)C2)C1=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.51
CHRM4 P08173 4/20 0.51
CHRM1 P11229 4/20 0.51
CHRM3 P20309 2/20 0.51
AADAT Q8N5Z0 2/20 0.45
GOT1 P17174 1/20 0.45
KYAT1 Q16773 1/20 0.45
KYAT3 Q6YP21 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PYGL P06737 2/20 0.43
CCKBR P32239 4/20 0.42
SCN9A Q15858 2/20 0.41
SCN10A Q9Y5Y9 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL4069399 0.93 CHRM2 (0.48) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4075043 0.87 CHRM2 (0.56) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4075145 0.87 CHRM2 (0.53) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4073094 0.87 CHRM2 (0.49) CHRM2CHRM4CHRM1CHRM3HSD17B10
SCHEMBL4066762 0.86 PYGL (0.54) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4064775 0.84 PYGL (0.52) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4069396 0.80 CHRM2 (0.47) CHRM2CHRM4CHRM1CHRM3HSD17B10
SCHEMBL4066626 0.80 AADAT (0.49) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL4250747 0.80 SMN1; SMN2 (0.55) CHRM2CHRM4CHRM1CHRM3AADAT
SCHEMBL7088452 0.78 CHRM2 (0.58) CHRM2CHRM4CHRM1CHRM3CCKBR

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