SCHEMBL8770739

SCHEMBL8770739

CCCCCCOC(=O)CC(N)CCCCC

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.56
HTR2C P28335 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
RAD52 P43351 1/20 0.49
FAAH O00519 1/20 0.47
DGKA P23743 1/20 0.47
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
S1PR2 O95136 5/20 0.45
S1PR1 P21453 5/20 0.45
S1PR3 Q99500 5/20 0.45
S1PR4 O95977 4/20 0.45
EPHX1 P07099 1/20 0.44

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
SCHEMBL11421457 1.00 NAAA (0.56) NAAAHTR2CNPSR1RAD52FAAH
SCHEMBL5721004 0.95 NAAA (0.48) NAAAHTR2CNPSR1RAD52FAAH
SCHEMBL30998049 0.93 NAAA (0.47) NAAAHTR2CNPSR1RAD52DGKA
SCHEMBL5720929 0.91 NAAA (0.44) NAAAHTR2CNPSR1DGKAMAPT
SCHEMBL4935831 0.88 S1PR2 (0.46) S1PR2S1PR1S1PR3S1PR4
SCHEMBL4931761 0.88 S1PR2 (0.46) S1PR2S1PR1S1PR3S1PR4
SCHEMBL3223213 0.86 TP53 (0.44) S1PR2S1PR1S1PR3S1PR4
SCHEMBL1140577 0.86 TP53 (0.44) S1PR2S1PR1S1PR3S1PR4
SCHEMBL31528814 0.85 DGKA (0.65) NAAAHTR2CDGKAMAPTPRSS1
SCHEMBL31528807 0.85 DGKA (0.65) NAAAHTR2CDGKAMAPTPRSS1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0797579-A1 ERYTHROMYCIN A 9-0-OXIME DERIVATIVES ENDOWED WITH ANTIBIOTIC ACTIVITY ZAMBON GROUP S.p.A. (IT) 1997-10-01 EP disclosed
WO-1996018633-A1 ERYTHROMYCIN A 9-0-OXIME DERIVATIVES ENDOWED WITH ANTIBIOTIC ACTIVITY ZAMBON GROUP S.P.A. (IT) 1996-06-20 WO disclosed