SCHEMBL2366564

SCHEMBL2366564

O=C(c1ccc(Br)cc1)N1CCN(c2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
HPGD P15428 4/20 0.63
KDM4E B2RXH2 3/20 0.63
NPSR1 Q6W5P4 3/20 0.63
MAPT P10636 5/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2C9 P11712 2/20 0.59
CYP2C19 P33261 2/20 0.59
GPR183 P32249 2/20 0.58
TSHR P16473 1/20 0.56
AKR1C3 P42330 1/20 0.56
MGLL Q99685 1/20 0.54
MAPK1 P28482 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
STAT3 P40763 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
GAA P10253 2/20 0.54
HTT P42858 1/20 0.54
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL9978123 0.80 MEN1 (0.87) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL23777678 0.77 AKR1C3 (0.66) ALDH1A1AKR1C3MAPK1MEN1KMT2A
SCHEMBL2546101 0.77 AKR1C3 (0.52) ALDH1A1HPGDKDM4ENPSR1MAPT
SCHEMBL2366481 0.77 HTT (0.76) ALDH1A1HPGDKDM4EMAPTGPR183
SCHEMBL9585721 0.75 POLB (0.81) ALDH1A1HPGDMAPTGPR183AKR1C3
SCHEMBL10722382 0.75 POLB (0.81) ALDH1A1HPGDMAPTGPR183AKR1C3
SCHEMBL27298400 0.74 GAA (0.65) ALDH1A1HPGDKDM4ENPSR1MAPT
SCHEMBL5371849 0.74 MEN1 (0.56) ALDH1A1HPGDNPSR1MAPTCYP2C9
SCHEMBL1903214 0.74 GRM5 (0.64) NPSR1MAPTTSHRAKR1C3SMN1; SMN2
SCHEMBL1904905 0.74 AKR1C3 (0.61) ALDH1A1NPSR1MAPTTSHRAKR1C3

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
EP-2364975-B1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORP (JP) 2013-06-12 EP disclosed
US-8354401-B2 Oxazolidinone amide aromatic compounds for supressing MMP-9 production MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-01-15 US disclosed
US-8354401-B2 Oxazolidinone amide aromatic compounds for supressing MMP-9 production MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-01-15 US disclosed
US-8354401-B2 Oxazolidinone amide aromatic compounds for supressing MMP-9 production MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-01-15 US disclosed
US-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-27 US disclosed
US-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-27 US disclosed
US-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-27 US disclosed
EP-2364975-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2011-09-14 EP disclosed
WO-2010050461-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE 田辺三菱製薬株式会社 (JP) 2010-05-06 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-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP2 ALDH1A1 598/4885HPGD 135/4885KDM4E 1064/4885

“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.