SCHEMBL5592138

SCHEMBL5592138

O=C(N1CCOCC1)N1CCN(CCCN2C(=O)CCCC2=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TP53 P04637 1/20 0.47
AKR1C3 P42330 3/20 0.47
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.40
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTR7 P34969 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 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
Hydrochloric Acid SCHEMBL5592211 0.99 MEN1 (0.46) MEN1KMT2ATP53AKR1C3HRH2
SCHEMBL5592381 0.79 CHRM1 (0.44) GAAALDH1A1
SCHEMBL9470544 0.78 KEAP1 (0.48) POLBSMN1; SMN2
SCHEMBL19588475 0.77 ADRA1B (0.47) MEN1KMT2APOLBSMN1; SMN2GAA
SCHEMBL5592305 0.75 MEN1 (0.36) MEN1KMT2ATP53AKR1C3POLB
SCHEMBL5592132 0.75 HRH2 (0.49) HRH2HRH1GAAALDH1A1
Hydrochloric Acid SCHEMBL5599015 0.74 MEN1 (0.35) MEN1KMT2ATP53AKR1C3POLB
SCHEMBL5592315 0.74 AKR1C3 (0.44) MEN1KMT2ATP53AKR1C3POLB
Hydrochloric Acid SCHEMBL5592382 0.74 HRH2 (0.48) KMT2AHRH2HRH1GAAALDH1A1
SCHEMBL5592302 0.72 ALDH1A1 (0.39) MEN1KMT2ATP53HRH2HRH1

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