SCHEMBL11560232

SCHEMBL11560232

CCCCCCCCCCCCCCCCCCCNc1ccc(C(=O)OC)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
MGLL Q99685 4/20 0.61
SCN5A Q14524 2/20 0.60
ABCB11 O95342 1/20 0.60
CYP3A4 P08684 1/20 0.60
ADRA2B P18089 1/20 0.60
OPRD1 P41143 1/20 0.60
LMNA P02545 2/20 0.58
CYP1A2 P05177 1/20 0.58
MAOA P21397 1/20 0.58
CNR1 P21554 1/20 0.58
DRD4 P21917 1/20 0.58
ACHE P22303 1/20 0.58
HRH2 P25021 1/20 0.58
HTR2A P28223 1/20 0.58
HTR2C P28335 1/20 0.58
MAPK1 P28482 1/20 0.58
NTSR1 P30989 1/20 0.58
HRH1 P35367 1/20 0.58
DRD3 P35462 1/20 0.58

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
SCHEMBL11565392 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL11075289 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL2310585 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL11560046 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL11564179 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL29114255 1.00 POLB (0.62) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL3944091 0.98 POLB (0.64) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL14149520 0.93 SCN5A (0.68) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL11496353 0.89 POLB (0.54) POLBMGLLSCN5AABCB11CYP3A4
SCHEMBL11496351 0.89 POLB (0.54) POLBMGLLSCN5AABCB11CYP3A4

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-4154756-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1979-05-15 US disclosed