SCHEMBL4483467

SCHEMBL4483467

Cc1cccc(CNC(=O)c2ccc(O)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.59
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
HSD17B10 Q99714 1/20 0.58
MAOB P27338 1/20 0.57
PPARG P37231 1/20 0.56
ROCK2 O75116 2/20 0.56
ROCK1 Q13464 1/20 0.56
MAPT P10636 1/20 0.54
THRB P10828 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
POLB P06746 2/20 0.54
ESR1 P03372 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
NR1H4 Q96RI1 1/20 0.53
EGFR P00533 1/20 0.52
CA1 P00915 1/20 0.51

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
SCHEMBL3422647 0.89 ROCK2 (0.62) MMP13ALDH1A1HPGDPPARGROCK2
SCHEMBL4977146 0.88 ALDH1A1 (0.65) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5325191 0.87 MMP13 (0.58) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL29936927 0.86 CA1 (0.66) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL18773969 0.85 CA1 (0.69) ALDH1A1MEN1KMT2APOLBNR1H4
SCHEMBL14724810 0.84 GAA (0.62) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL14797152 0.84 MMP13 (0.58) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30780038 0.84 GAA (0.62) MMP13KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4927927 0.82 HASPIN (0.58) ALDH1A1HPGDROCK2ROCK1NR1H4
SCHEMBL4491907 0.81 ALDH1A1 (0.69) MMP13KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101230033-B New azabicycloalkane derivatives, preparing method and medicament combination containing the same SERVIER LAB 2011-03-09 CN disclosed
CN-100577160-C Novel azabicyclo derivatives, preparation method thereof and pharmaceutical compositions containing same SERVIER LAB 2010-01-06 CN disclosed
US-7576120-B2 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-08-18 US disclosed
CN-101230033-A New azabicycloalkane derivatives, preparing method and medicament combination containing the same SERVIER LAB (FR) 2008-07-30 CN disclosed
EP-1720544-B1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2008-03-19 EP disclosed
US-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. LES LABORATORATIES SERVIER (FR) 2007-08-23 US disclosed
CN-1921848-A Novel azabicyclo derivatives, preparation method thereof and pharmaceutical compositions containing same SERVIER LAB (FR) 2007-02-28 CN disclosed
EP-1720544-A1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Les Laboratoires Servier (FR) 2006-11-15 EP disclosed
WO-2005089747-A1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2005-09-29 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-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. HRH2, HNMT, HRH1 MMP13 4375/4885KDM4E 461/4885ALDH1A1 308/4885

“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.