SCHEMBL21585643

SCHEMBL21585643

CCCCCCCCCCCCN[C@@H](C)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.49
EPHX1 P07099 6/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ACE2 Q9BYF1 2/20 0.45
MME P08473 1/20 0.45
ACE P12821 1/20 0.45
CPA1 P15085 1/20 0.45
SLC6A5 Q9Y345 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
NOD1 Q9Y239 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
PLA2G2A P14555 1/20 0.41
PLA2G5 P39877 1/20 0.41
MMP8 P22894 1/20 0.40

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
SCHEMBL21585650 1.00 FAAH (0.49) FAAHEPHX1SMN1; SMN2ACE2MME
SCHEMBL4979262 0.98 FAAH (0.46) FAAHEPHX1SMN1; SMN2ACE2MME
SCHEMBL1574127 0.98 FAAH (0.46) FAAHEPHX1SMN1; SMN2ACE2MME
SCHEMBL4979248 0.98 FAAH (0.46) FAAHEPHX1SMN1; SMN2ACE2MME
SCHEMBL5615746 0.93 FAAH (0.47) FAAHEPHX1SMN1; SMN2ACE2MME
SCHEMBL352163 0.87 EPHX1 (0.48) FAAHEPHX1SMN1; SMN2ACE2FNTA
SCHEMBL22325587 0.87 EPHX1 (0.48) FAAHEPHX1SMN1; SMN2ACE2FNTA
SCHEMBL9436902 0.87 EPHX1 (0.48) FAAHEPHX1SMN1; SMN2ACE2FNTA
SCHEMBL6758775 0.87 EPHX1 (0.48) FAAHEPHX1SMN1; SMN2ACE2FNTA
SCHEMBL10579468 0.87 EPHX1 (0.48) FAAHEPHX1SMN1; SMN2ACE2FNTA

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-2019233377-A1 NOVEL SELF-ASSEMBLED AMINO ACID SUPRAMOLECULAR POLYMER, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 苏州欧丽特生物医药有限公司 (CN) 2019-12-12 WO disclosed