SCHEMBL2848362

SCHEMBL2848362

CCOC(=O)C(=O)C(CC)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
GAA P10253 2/20 0.46
HTT P42858 2/20 0.43
EPHX2 P34913 1/20 0.42
CYP19A1 P11511 1/20 0.41
KYAT1 Q16773 1/20 0.40
TSHR P16473 2/20 0.40
ABCB11 O95342 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR2A P28223 1/20 0.40
PMP22 Q01453 1/20 0.40
PPARA Q07869 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39

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
SCHEMBL2853000 0.85 KMT2A (0.48) ALDH1A1TDP1GAAKYAT1MAPT
SCHEMBL25179993 0.83 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL277081 0.83 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL4800700 0.82 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL2222084 0.79 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL9019162 0.79 L3MBTL1 (0.48) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL14338895 0.79 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1TDP1GAAHTT
SCHEMBL11033678 0.79 HTT (0.49) SMN1; SMN2ALDH1A1GAAHTTTSHR
SCHEMBL904487 0.79 HTT (0.51) ALDH1A1HTTEPHX2TSHRMAPT
SCHEMBL11250768 0.78 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1TDP1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8354442-B2 Imidazol-4-one and imidazole-4-thione compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2013-01-15 US disclosed
WO-2010062686-A2 IMIDAZOL-4-ONE AND IMIDAZOLE-4-THIONE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-06-03 WO disclosed
US-20100113546-A1 Imidazol-4-one and Imidazole-4-thione Compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-05-06 US disclosed
CN-100467463-C Pyrazolylindolyl derivatives as PPAR activators HOFFMANN LA ROCHE (CH) 2009-03-11 CN disclosed
EP-1725546-B1 PYRAZOLYL INDOLYL DERIVATIVES AS PPAR ACTIVATORS HOFFMANN LA ROCHE (CH) 2008-10-08 EP disclosed
US-7265149-B2 Indolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-09-04 US disclosed
CN-1930150-A Pyrazolyl indolyl derivatives as PPAR activators HOFFMANN LA ROCHE (CH) 2007-03-14 CN disclosed
EP-1725546-A1 PYRAZOLYL INDOLYL DERIVATIVES AS PPAR ACTIVATORS F.HOFFMANN-LA ROCHE AG (CH) 2006-11-29 EP disclosed
WO-2005085235-A1 PYRAZOLYL INDOLYL DERIVATIVES AS PPAR ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-15 WO disclosed
US-20050203160-A1 Indolyl derivatives HOFFMANN-LA ROCHE INC. 2005-09-15 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 (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-20100113546-A1 Imidazol-4-one and Imidazole-4-thione Compounds CNR1, CNR2, HRH4 SMN1; SMN2 3345/4885ALDH1A1 2567/4885TDP1 1286/4885
US-20050203160-A1 Indolyl derivatives PPARD, PPARA, PPARG SMN1; SMN2 4244/4885ALDH1A1 799/4885TDP1 2766/4885

“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.