SCHEMBL4491907

SCHEMBL4491907

Cc1ccc(CNC(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.69
MAPT P10636 3/20 0.69
HTT P42858 2/20 0.69
KDM4E B2RXH2 2/20 0.69
LMNA P02545 1/20 0.65
MEN1 O00255 3/20 0.64
POLB P06746 3/20 0.64
KMT2A Q03164 3/20 0.64
MAPK14 Q16539 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
BLM P54132 2/20 0.64
RECQL P46063 1/20 0.64
MCL1 Q07820 1/20 0.64
HDAC1 Q13547 3/20 0.59
HDAC6 Q9UBN7 2/20 0.59
CYP3A4 P08684 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MMP2 P08253 1/20 0.58
STAT3 P40763 1/20 0.58
MMP13 P45452 1/20 0.58

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
SCHEMBL13947068 1.00 ALDH1A1 (0.69) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL13932522 0.93 ALDH1A1 (0.78) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL9416580 0.91 HDAC6 (0.64) MAPTBLMHDAC1HDAC6CYP3A4
SCHEMBL6357065 0.85 LMNA (0.70) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL25872270 0.85 MEN1 (0.72) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL16436155 0.85 EPHX2 (0.72) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL13947380 0.85 MEN1 (0.72) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL18235888 0.85 ALDH1A1 (0.68) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL10099594 0.85 LMNA (0.70) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL13947450 0.85 EPHX2 (0.72) ALDH1A1MAPTHTTKDM4ELMNA

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
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
US-5382680-A Allosteric hemoglobin modifier compounds THE CENTER FOR INNOVATIVE TECHNOLOGY (US) 1995-01-17 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-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. HRH2, HNMT, HRH1 ALDH1A1 308/4885MAPT 4412/4885HTT 1241/4885

“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.