SCHEMBL10840973

SCHEMBL10840973

CN1C(=O)CN(N(C(=O)O)c2ccccc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 4/20 0.35
CHRM3 P20309 4/20 0.35
ALDH1A1 P00352 2/20 0.34
CHRM5 P08912 3/20 0.33
CHRM1 P11229 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
CASP2 P42575 1/20 0.33
APP P05067 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
HSP90AA1 P07900 1/20 0.32
CHRM2 P08172 1/20 0.32
TSHR P16473 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
SCHEMBL10839441 0.76 PLA2G7 (0.40) CHRM4CHRM3ALDH1A1CHRM5CHRM1
SCHEMBL11139063 0.73 CHRM3 (0.39) CHRM4CHRM3ALDH1A1CHRM5CHRM1
SCHEMBL10839086 0.73 CHRM3 (0.39) CHRM4CHRM3ALDH1A1CHRM5CHRM1
SCHEMBL10839648 0.70 CHRM3 (0.40) CHRM4CHRM3CHRM5CHRM1HPGD
SCHEMBL11711601 0.69 NPSR1 (0.39) ALDH1A1SMN1; SMN2HPGDNPSR1HSP90AA1
SCHEMBL14060985 0.68 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL10838381 0.67 CHRM3 (0.39) CHRM4CHRM3ALDH1A1CHRM5CHRM1
SCHEMBL2536250 0.65 NPC1 (0.54) ALDH1A1SMN1; SMN2HPGD
SCHEMBL9804356 0.65 KMT2A (0.35) ALDH1A1HPGDAPPNPSR1TSHR
Phenol SCHEMBL11576606 0.65 PLA2G7 (0.44) ALDH1A1SMN1; SMN2TSHR

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
US-4578107-A Herbicidal imidazolidine-2-one derivatives OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1986-03-25 US disclosed