SCHEMBL15324528

SCHEMBL15324528

CC(C)(C)OC(=O)/N=C(/N)NNC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.40
GAA P10253 5/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MIF P14174 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CTSK P43235 2/20 0.33
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL601561 0.83 MAOA (0.36) GAAMEN1KMT2AMAOAMAOB
SCHEMBL3728300 0.83 MAOA (0.36) GAAMEN1KMT2AMAOAMAOB
SCHEMBL601562 0.83 MAOA (0.36) GAAMEN1KMT2AMAOAMAOB
SCHEMBL6379683 0.79 DGAT1 (0.34) GAAMEN1KMT2AALDH1A1MAOA
SCHEMBL28705194 0.79 DGAT1 (0.34) MAOAMAOBLMNA
SCHEMBL19273270 0.78 APLNR (0.48) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL23746404 0.77 DGAT1 (0.42) MAOAMAOBCA12CA14
SCHEMBL3808765 0.77 CRBN (0.34) MAOAMAOBCTSK
SCHEMBL3808762 0.77 CRBN (0.34) MAOAMAOBCTSK
SCHEMBL284141 0.77 APLNR (0.55) APLNRGAAMEN1KMT2AMAPK1

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-20130274229-A1 ENHANCED ANTI-INFLUENZA AGENTS CONJUGATED WITH ANTI-INFLAMMATORY ACTIVITY ACADEMIA SINICA (TW) 2013-10-17 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-20130274229-A1 ENHANCED ANTI-INFLUENZA AGENTS CONJUGATED WITH ANTI-INFLAMMATORY ACTIVITY NEU1, CTSA, CA7 APLNR 2272/4885GAA 133/4885MEN1 4762/4885

“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.