SCHEMBL5058539

SCHEMBL5058539

CCCCCCCCCCC(S)C(=O)NCC(O)CO

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.43
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
GPR84 Q9NQS5 7/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
FFAR1 O14842 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
DUSP3 P51452 1/20 0.40
ASAH1 Q13510 1/20 0.39

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
SCHEMBL14655966 0.83 FFAR4 (0.45) FAAHDRD3SLC6A3GPR84MEN1
SCHEMBL7920334 0.80 MEN1 (0.46) FAAHDRD3SLC6A3GPR84MEN1
SCHEMBL2638784 0.78 FFAR4 (0.44) FAAHMEN1KMT2AFFAR1FFAR4
SCHEMBL8061869 0.78 DRD3 (0.39) FAAHDRD3SLC6A3GPR84MEN1
SCHEMBL7906858 0.78 FFAR4 (0.44) FAAHMEN1KMT2AFFAR1FFAR4
SCHEMBL2484971 0.77 DRD3 (0.39) FAAHDRD3SLC6A3GPR84MEN1
SCHEMBL2484974 0.76 GPR84 (0.40) FAAHDRD3SLC6A3GPR84MEN1
SCHEMBL20942646 0.74 HDAC7 (0.44) DRD3SLC6A3
SCHEMBL28473057 0.74 FAAH (0.42) FAAHGPR84MEN1KMT2AFFAR1
SCHEMBL24339916 0.73 FAAH (0.58) FAAHMEN1KMT2ALMNAKDM4E

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-2008028206-A2 METHOD FOR PRODUCING REACTIVE MONOLAYER UNITS Universität Linz (AT) 2008-03-13 WO disclosed