SCHEMBL889148

SCHEMBL889148

CCCNC(=O)CCNCCCN(CCC(=O)NCCC)CCC(=O)NCCC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.45
DNM1 Q05193 2/20 0.45
NAAA Q02083 1/20 0.42
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
GAA P10253 1/20 0.41
FAAH O00519 3/20 0.41
CASP2 P42575 1/20 0.41
CNR1 P21554 1/20 0.40
ICMT O60725 1/20 0.39
ALB P02768 1/20 0.39
EPHX1 P07099 1/20 0.38
MCL1 Q07820 1/20 0.37

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
SCHEMBL12791709 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL12792217 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL12792190 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL12791923 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL12792093 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL652484 0.89 NAAA (0.58) PAOXDNM1NAAAFAAHCASP2
SCHEMBL13755911 0.88 PAOX (0.46) PAOXDNM1NAAAKDM4EHSD17B10
SCHEMBL9290503 0.88 NAAA (0.57) PAOXDNM1NAAAFAAHCASP2
SCHEMBL25607772 0.88 NAAA (0.57) PAOXDNM1NAAAFAAHCASP2
SCHEMBL889191 0.88 DNM1 (0.49) DNM1NAAAGAAFAAHCASP2

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-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-01-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE FCGRT, MYD88, C3AR1 PAOX 1247/4885DNM1 4279/4885NAAA 789/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.