SCHEMBL17244055

SCHEMBL17244055

CCCCCCCCCCCCCC(=O)NCC(=O)NC(Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.79
▸ FAAH O00519 4/20 0.62
▸ CNR1 P21554 2/20 0.62
▸ CNR2 P34972 2/20 0.62
▸ EPHX2 P34913 1/20 0.53
▸ ITGB2 P05107 3/20 0.50
▸ ICAM1 P05362 3/20 0.50
▸ ITGAL P20701 3/20 0.50
▸ SLC15A2 Q16348 1/20 0.48
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ NOD1 Q9Y239 1/20 0.43

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
SCHEMBL17244054 1.00 SLC6A5 (0.79) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL23227554 1.00 SLC6A5 (0.79) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL17204083 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL22034112 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL4348859 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL15650015 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL17817155 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL13279669 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL15649758 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL9664374 0.92 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2

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
US-9180201-B2 Method for preparing lipopeptide compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-11-10 — — US disclosed
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