SCHEMBL889280

SCHEMBL889280

CCCNC(=O)CCN(CCCNCCC(=O)OCCC)CCC(=O)NCCC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
DNM1 Q05193 3/20 0.38
PAOX Q6QHF9 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
LTA4H P09960 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
MAPT P10636 1/20 0.35
NAAA Q02083 1/20 0.35
EPHX2 P34913 1/20 0.34
DGKA P23743 1/20 0.34

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
SCHEMBL889248 0.89 SMN1; SMN2 (0.39) DNM1SMN1; SMN2L3MBTL1GAACNR1
SCHEMBL889201 0.89 PAOX (0.43) KDM4EHSD17B10ALOX15DNM1PAOX
SCHEMBL889148 0.86 PAOX (0.45) KDM4EHSD17B10ALOX15DNM1PAOX
SCHEMBL889254 0.80 FAAH (0.48) DNM1PAOXNAAADGKA
SCHEMBL12792458 0.80 FAAH (0.48) DNM1PAOXNAAADGKA
SCHEMBL12792529 0.80 FAAH (0.48) DNM1PAOXNAAADGKA
SCHEMBL19976134 0.79 LTA4H (0.39) DNM1PAOXLTA4HEPHX2DGKA
SCHEMBL9972626 0.78 FAAH (0.49) DNM1PAOXNAAADGKA
SCHEMBL889250 0.78 DGKA (0.48) DNM1PAOXLTA4HMAPTNAAA
SCHEMBL889191 0.78 DNM1 (0.49) DNM1GAACNR1NAAA

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 KDM4E 4572/4885HSD17B10 2578/4885ALOX15 60/4885

“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.