SCHEMBL10099583

SCHEMBL10099583

CC(C)CCCCCNC(=O)c1ccc(O)nc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
GRM5 P41594 1/20 0.49
FOLH1 Q04609 2/20 0.45
NAMPT P43490 1/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 1/20 0.43
MAPK1 P28482 1/20 0.43
NAAA Q02083 1/20 0.43
EPHX2 P34913 2/20 0.42
DEGS1 O15121 1/20 0.42
KDM4C Q9H3R0 1/20 0.42

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
SCHEMBL10099596 0.85 L3MBTL1 (0.61) KDM4ENPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL13286818 0.81 KDM4E (0.53) KDM4ENPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL9829017 0.81 MAPK1 (0.69) KDM4EFOLH1SMN1; SMN2MAPK1
SCHEMBL10099585 0.81 MAPK1 (0.69) KDM4EFOLH1SMN1; SMN2MAPK1
SCHEMBL10099539 0.79 L3MBTL1 (0.69) NPC1RAB9ASMN1; SMN2L3MBTL1MAPK1
SCHEMBL29038558 0.78 EPHX2 (0.64) NAMPTNPC1RAB9ASMN1; SMN2EPHX2
SCHEMBL27117782 0.78 KDM4E (0.51) KDM4ENAMPTNPC1RAB9ASMN1; SMN2
SCHEMBL29038551 0.77 NAAA (0.70) KDM4ENPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL18534318 0.77 NPC1 (0.56) FOLH1NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL11282161 0.77 NPC1 (0.53) KDM4ENPC1RAB9ASMN1; SMN2L3MBTL1

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 KDM4E 3609/4885GRM5 2857/4885FOLH1 416/4885

“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.