SCHEMBL5280818

SCHEMBL5280818

CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 4/20 0.53
ACE P12821 7/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
REN P00797 4/20 0.47
KDM4E B2RXH2 1/20 0.47
F2 P00734 1/20 0.47
LMNA P02545 1/20 0.47
LTA4H P09960 1/20 0.47
MAPT P10636 1/20 0.47
PEPD P12955 1/20 0.47
ALOX15 P16050 1/20 0.47
PTGS1 P23219 1/20 0.47
HTR2A P28223 1/20 0.47
PTGS2 P35354 1/20 0.47
HRH1 P35367 1/20 0.47
THPO P40225 1/20 0.47

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
SCHEMBL10404192 1.00 CMA1 (0.53) CMA1ACEPOLBKMT2AL3MBTL1
SCHEMBL10404191 1.00 CMA1 (0.53) CMA1ACEPOLBKMT2AL3MBTL1
SCHEMBL27485070 0.90 POLB (0.48) CMA1ACEPOLBKMT2ACTSS
SCHEMBL7330566 0.90 KLK5 (0.49) CMA1ACEPOLBCTSSCTSK
SCHEMBL5696171 0.90 POLB (0.48) CMA1ACEPOLBKMT2ACTSS
SCHEMBL5696170 0.90 POLB (0.48) CMA1ACEPOLBKMT2ACTSS
SCHEMBL3604870 0.90 POLB (0.48) CMA1ACEPOLBKMT2ACTSS
SCHEMBL7330561 0.90 KLK5 (0.49) CMA1ACEPOLBCTSSCTSK
SCHEMBL2162326 0.88 CMA1 (0.61) CMA1ACECTSKRENELANE
SCHEMBL8168155 0.88 CMA1 (0.61) CMA1ACECTSKRENELANE

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
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 CMA1 1486/4885ACE 2939/4885POLB 820/4885

“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.