SCHEMBL10099596

SCHEMBL10099596

CCCCCCNC(=O)c1ccc(O)nc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.61
NAAA Q02083 4/20 0.60
MLYCD O95822 1/20 0.56
CA2 P00918 1/20 0.55
KDM4E B2RXH2 2/20 0.54
THRA P10827 1/20 0.52
THRB P10828 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
HCAR3 P49019 1/20 0.49
CNR1 P21554 1/20 0.48
MAPK14 Q16539 1/20 0.47
MAPK1 P28482 1/20 0.46

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
SCHEMBL27117782 0.88 KDM4E (0.51) L3MBTL1KDM4ESMN1; SMN2ALDH1A1KMT2A
SCHEMBL8824851 0.85 L3MBTL1 (0.61) L3MBTL1NAAAMLYCDCA2KDM4E
SCHEMBL18116704 0.85 KDM4E (0.74) L3MBTL1NAAAMLYCDCA2KDM4E
SCHEMBL10099583 0.85 KDM4E (0.50) L3MBTL1NAAAKDM4ESMN1; SMN2NPC1
SCHEMBL13286818 0.84 KDM4E (0.53) L3MBTL1KDM4ESMN1; SMN2MEN1MAPT
SCHEMBL12387878 0.84 L3MBTL1 (0.60) L3MBTL1NAAAMLYCDCA2KDM4E
SCHEMBL31365964 0.84 L3MBTL1 (0.60) L3MBTL1NAAAMLYCDCA2KDM4E
SCHEMBL9829017 0.84 MAPK1 (0.69) CA2KDM4ESMN1; SMN2ALDH1A1MAPK1
SCHEMBL10099585 0.84 MAPK1 (0.69) CA2KDM4ESMN1; SMN2ALDH1A1MAPK1
SCHEMBL5426967 0.84 KDM4E (0.76) L3MBTL1NAAAMLYCDCA2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093227-B2 Monosaccharide compounds and methods therefor ALCHEMIA PTY LTD (AU) 2012-01-10 US disclosed
US-20100184607-A1 MONOSACCHARIDE COMPOUNDS AND METHODS THEREFOR ALCHEMIA PTY LTD. (AU) 2010-07-22 US disclosed
US-7417129-B2 Combinatorial libraries of monosaccharides ALCHEMIA PTY LTD (AU) 2008-08-26 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-20100184607-A1 MONOSACCHARIDE COMPOUNDS AND METHODS THEREFOR SLC5A1, UGGT1, MRPL21 L3MBTL1 2971/4885NAAA 2912/4885MLYCD 584/4885

“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.