SCHEMBL1780965

SCHEMBL1780965

OCC(O)CNC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 6/20 0.47
CNR1 P21554 4/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
AOC3 Q16853 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35

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
SCHEMBL10029043 0.81 RAB9A (0.54) AOC3LMNA
SCHEMBL27006320 0.75 AOC3 (0.47) TDP1HPGDAOC3LMNASMN1; SMN2
SCHEMBL27130324 0.75 AOC3 (0.47) TDP1HPGDAOC3LMNASMN1; SMN2
SCHEMBL14316409 0.72 KMT2A (0.50) AKT1SLC6A2SLC6A4SLC6A3HPGD
Oxalic Acid SCHEMBL1573558 0.72 MEN1 (0.46) CNR1TDP1LMNA
SCHEMBL1155443 0.69 AOC3 (0.53) TDP1HPGDAOC3LMNASMN1; SMN2
SCHEMBL5437078 0.69 AOC3 (0.53) TDP1HPGDAOC3LMNASMN1; SMN2
SCHEMBL4297797 0.69 AOC3 (0.53) TDP1HPGDAOC3LMNASMN1; SMN2
SCHEMBL11592029 0.68 RAB9A (0.52) TDP1HTTAOC3LMNA
SCHEMBL8372487 0.68 MEN1 (0.50) CNR1LMNAHDAC4HDAC7HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229355-B1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI SA (FR) 2012-09-19 EP claimed
US-8207355-B2 Method for preparing azetidine derivatives SANOFI-AVENTIS (FR) 2012-06-26 US claimed
US-20110118481-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2011-05-19 US claimed
EP-2229355-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES Sanofi-Aventis (FR) 2010-09-22 EP claimed
WO-2009103883-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2009-08-27 WO claimed
EP-2229355-B1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI SA (FR) 2012-09-19 EP disclosed
US-8207355-B2 Method for preparing azetidine derivatives SANOFI-AVENTIS (FR) 2012-06-26 US disclosed
US-8207355-B2 Method for preparing azetidine derivatives SANOFI-AVENTIS (FR) 2012-06-26 US disclosed
US-8207355-B2 Method for preparing azetidine derivatives SANOFI-AVENTIS (FR) 2012-06-26 US disclosed
US-20110118481-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
US-20110118481-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
US-20110118481-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
EP-2229355-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES Sanofi-Aventis (FR) 2010-09-22 EP disclosed
WO-2009103883-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2009-08-27 WO disclosed
WO-2009103883-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES SANOFI-AVENTIS (FR) 2009-08-27 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-20110118481-A1 METHOD FOR PREPARING AZETIDINE DERIVATIVES QDPR, AZI2, NISCH AKT1 2872/4885CNR1 2397/4885SLC6A2 834/4885

“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.