SCHEMBL9540248

SCHEMBL9540248

CCCCN1CCCC(CC(=O)OCC)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.47
CHRNB2 P17787 2/20 0.39
CHRNB4 P30926 2/20 0.39
CHRNA3 P32297 2/20 0.39
CHRNA4 P43681 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
USP14 P54578 1/20 0.38
HTR7 P34969 2/20 0.38
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 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
SCHEMBL14388165 0.85 USP14 (0.42) BCHEKDM4EALDH1A1USP14
SCHEMBL7332383 0.82 HTR4 (0.43) HTR1ADRD2
SCHEMBL2607044 0.82 SMN1; SMN2 (0.45) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL13036975 0.81 BCHE (0.44) BCHEKDM4EALDH1A1HTR7HTR1A
SCHEMBL13036977 0.80 SMN1; SMN2 (0.45) BCHEKDM4EALDH1A1HTR7HTR1A
SCHEMBL6964631 0.78 SLC6A1 (0.53) DRD2
SCHEMBL8553634 0.77 POLB (0.45) KDM4EALDH1A1
SCHEMBL11709792 0.77 LMNA (0.45) KDM4EALDH1A1
SCHEMBL11712424 0.77 LMNA (0.45) KDM4EALDH1A1
SCHEMBL11717512 0.77 LMNA (0.45) KDM4EALDH1A1

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-1993003725-A1 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-03-04 WO disclosed