SCHEMBL6706546

SCHEMBL6706546

N#CCN1C(=O)CCC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.41
P2RX7 Q99572 8/20 0.37
CHRM2 P08172 4/20 0.33
CHRM4 P08173 4/20 0.33
CHRM5 P08912 4/20 0.33
CHRM1 P11229 4/20 0.33
CHRM3 P20309 4/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GYS1 P13807 1/20 0.32

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
SCHEMBL10754807 0.83 ACE (0.39) ACEP2RX7KMT2AMEN1POLB
SCHEMBL7826338 0.83 ACE (0.39) ACEP2RX7KMT2AMEN1POLB
SCHEMBL12923195 0.83 P2RX7 (0.36) ACEP2RX7CHRM2CHRM4CHRM5
SCHEMBL16515479 0.81 KMT2A (0.41) P2RX7KMT2AMEN1ALDH1A1
SCHEMBL983163 0.81 KMT2A (0.41) P2RX7KMT2AMEN1ALDH1A1
SCHEMBL28627005 0.80 ACE (0.39) ACEP2RX7CHRM2CHRM4CHRM5
SCHEMBL16521964 0.80 P2RX7 (0.39) P2RX7CHRM2CHRM4CHRM5CHRM1
SCHEMBL1914212 0.77 P2RX7 (0.51) ACEP2RX7KMT2A
SCHEMBL1587390 0.77 P2RX7 (0.51) ACEP2RX7KMT2A
SCHEMBL6694973 0.77 ACE (0.44) ACEP2RX7KMT2AMEN1POLB

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
JP-2004137178-A PYRROLIDINONE DERIVATIVE AND METHOD FOR PRODUCING THE SAME MITSUBISHI RAYON CO LTD 2004-05-13 JP disclosed