SCHEMBL5169119

SCHEMBL5169119

CCC(C=CNC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSK P43235 11/20 0.39
CTSS P25774 5/20 0.39
CA1 P00915 2/20 0.35
CA7 P43166 2/20 0.35
CA2 P00918 1/20 0.35
PPARA Q07869 2/20 0.33
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
PPARG P37231 1/20 0.33
SYK P43405 1/20 0.33
APLNR P35414 1/20 0.33
ACE P12821 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
SCHEMBL22662736 0.80 CTSK (0.41) MEN1GAAKMT2ACTSKCTSS
SCHEMBL20881200 0.80 CTSK (0.41) MEN1GAAKMT2ACTSKCTSS
SCHEMBL18901717 0.78 MEN1 (0.45) MEN1GAAKMT2ACTSKCTSS
SCHEMBL5166802 0.78 MEN1 (0.40) MEN1GAAKMT2ACTSKCTSS
SCHEMBL5170444 0.77 CTSK (0.41) MEN1GAAKMT2ACTSKCTSS
SCHEMBL5165493 0.77 CTSK (0.36) MEN1GAAKMT2ACTSKCTSS
SCHEMBL19435721 0.75 KDM4E (0.35)
SCHEMBL15096829 0.74 MAPK10 (0.41) MEN1GAAKMT2ACTSKCA1
SCHEMBL12571335 0.74 MAPK10 (0.41) MEN1GAAKMT2ACTSKCA1
SCHEMBL5167220 0.73 CA1 (0.40) MEN1GAAKMT2ACTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP disclosed
US-6964976-B2 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2005-11-15 US disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP 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 (2 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-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A MEN1 1906/4885GAA 4794/4885KMT2A 1760/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A MEN1 1906/4885GAA 4794/4885KMT2A 1760/4885

“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.