SCHEMBL5799574

SCHEMBL5799574

O=C(O)N1CCC(NCC(O)COc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
ALDH1A1 P00352 2/20 0.57
MAPT P10636 2/20 0.57
HTT P42858 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MITF O75030 1/20 0.57
MAPK1 P28482 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
ADRB1 P08588 7/20 0.55
ADRB3 P13945 7/20 0.55
ADRB2 P07550 6/20 0.55
DPP4 P27487 2/20 0.55
NPY1R P25929 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49

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
SCHEMBL5814362 1.00 LMNA (0.61) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL4894557 0.85 MEN1 (0.58) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL4894572 0.85 MEN1 (0.58) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL4584979 0.85 ADRB2 (0.54) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL25053044 0.85 ADRB1 (0.69) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL20854554 0.84 DRD4 (0.67) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL24225590 0.81 MEN1 (0.58) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL7367153 0.81 KMT2A (0.67) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL20883491 0.81 LMNA (0.64) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL20883380 0.79 LMNA (0.57) LMNAMEN1KMT2AALDH1A1MAPT

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
WO-2006060122-A9 CARDIOTONIC COMPOUNDS WITH INHIBITORY ACTIVITY AGAINST BETA-ADRENERGIC RECEPTORS AND PHOSPHODIESTERASE ARTESIAN THERAPEUTICS INC (US) 2006-08-17 WO disclosed