SCHEMBL5592302

SCHEMBL5592302

CC(=O)OCC(=O)N1CCN(CCCN2C(=O)CCCC2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 2/20 0.38
KDM1A O60341 1/20 0.38
HTR7 P34969 2/20 0.37
CYP1A2 P05177 1/20 0.37
HTR1A P08908 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
DRD2 P14416 5/20 0.36
DRD4 P21917 5/20 0.36
DRD3 P35462 5/20 0.36
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36

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
Hydrochloric Acid SCHEMBL5592223 0.99 ALDH1A1 (0.39) ALDH1A1TP53MAPTMEN1KMT2A
SCHEMBL5592132 0.80 HRH2 (0.49) ALDH1A1HRH2HRH1
Hydrochloric Acid SCHEMBL5592382 0.79 HRH2 (0.48) ALDH1A1MAPTKMT2AHPGDHTT
SCHEMBL12251945 0.78 ALDH1A1 (0.43) ALDH1A1TP53MAPTMEN1KMT2A
SCHEMBL5592205 0.76 GRM5 (0.55) DRD2DRD4DRD3CHRM2CHRM4
SCHEMBL14012787 0.76 ALDH1A1 (0.46) ALDH1A1TP53MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL5592282 0.76 GRM5 (0.54) DRD2DRD4DRD3CHRM2CHRM4
SCHEMBL12251951 0.74 ALDH1A1 (0.45) ALDH1A1TP53MAPTKMT2APOLB
SCHEMBL5592138 0.72 MEN1 (0.47) ALDH1A1TP53MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL5592211 0.71 MEN1 (0.46) ALDH1A1TP53MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007029078-A2 SUCCINIMIDE AND GLUTARIMIDE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO claimed
WO-2007029078-A2 SUCCINIMIDE AND GLUTARIMIDE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO disclosed