SCHEMBL13945472

SCHEMBL13945472

O=C(O)c1ccc2c(c1)oc(=O)n2CCCCN1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.84

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.84
HTR2A P28223 1/20 0.84
SLC6A4 P31645 1/20 0.84
SLC6A3 Q01959 1/20 0.84
HTR1A P08908 4/20 0.59
HTR7 P34969 4/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
ATM Q13315 1/20 0.56

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
SCHEMBL12124408 0.91 SLC6A2 (1.00) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124505 0.91 SLC6A2 (0.78) SLC6A2HTR2ASLC6A4SLC6A3HTR1A
SCHEMBL12124491 0.90 SLC6A2 (0.98) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124469 0.90 SLC6A2 (0.98) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124486 0.89 SLC6A2 (0.82) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124445 0.89 SLC6A2 (0.96) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124674 0.88 SLC6A2 (0.93) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124482 0.85 SLC6A2 (0.89) SLC6A2HTR2ASLC6A4SLC6A3
SCHEMBL12124635 0.85 SLC6A2 (0.72) SLC6A2HTR2ASLC6A4SLC6A3HTR1A
SCHEMBL12124503 0.85 SLC6A2 (0.72) SLC6A2HTR2ASLC6A4SLC6A3HTR1A

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-2009026227-A2 HIGHLY SELECTIVE SIGMA RECEPTOR LIGANDS THE UNIVERSITY OF MISSISSIPPI (US) 2009-02-26 WO disclosed