SCHEMBL9844565

SCHEMBL9844565

CSc1ccc(C(O)CC(N)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.53
MAOA P21397 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
FAAH O00519 1/20 0.38
NOS3 P29474 2/20 0.37
NOS1 P29475 2/20 0.37
GRIK1 P39086 1/20 0.36
GRIK2 Q13002 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX5 P09917 1/20 0.35
TAAR1 Q96RJ0 2/20 0.35
HTR3A P46098 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL3405625 0.80 TAAR1 (0.57) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL7560499 0.78 SLC6A4 (0.48) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL6560714 0.78 SLC6A4 (0.59) SLC6A4MAOASLC6A2SLC6A3
SCHEMBL30815764 0.74 SLC6A4 (0.46) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL14392578 0.74 SLC6A4 (0.46) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL7557160 0.74 SLC6A4 (0.53) SLC6A4MAOASLC6A2SLC6A3NOS3
SCHEMBL19828349 0.73 SLC6A4 (0.44) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL2015502 0.73 SLC6A4 (0.44) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL11382547 0.73 SLC6A4 (0.44) SLC6A4MAOASLC6A2SLC6A3FAAH
SCHEMBL1034372 0.73 KDM4E (0.63) SLC6A4SLC6A2SLC6A3FAAHKDM4E

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
EP-0405104-A1 Process for preparing antibacterial compounds and intermediates thereto SCHERING CORPORATION (US) 1991-01-02 EP disclosed