SCHEMBL2366744

SCHEMBL2366744

Cc1cc(C2CC2)cnc1N1CCN(C(=O)c2ccc(N3CCOC3=O)cc2C#N)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 6/20 0.37
TDP1 Q9NUW8 1/20 0.37
PIK3CD O00329 4/20 0.36
PIK3CA P42336 4/20 0.36
FASN P49327 3/20 0.36
CASP1 P29466 4/20 0.36
HSD17B10 Q99714 4/20 0.36
LMNA P02545 3/20 0.36
CASP7 P55210 3/20 0.36
HTT P42858 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 3/20 0.36
USP2 O75604 2/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 2/20 0.36
ALOX15 P16050 1/20 0.36
IDH1 O75874 3/20 0.36
CFTR P13569 2/20 0.35
GAA P10253 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
SCHEMBL2365729 0.90 LMNA (0.36) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2366954 0.89 CFTR (0.40) KDM4EALDH1A1TDP1CASP1HSD17B10
SCHEMBL12240539 0.88 HTT (0.40) KDM4ELMNAHTTMAPTTSHR
SCHEMBL2366188 0.87 KDM4E (0.36) KDM4EALDH1A1TDP1PIK3CDPIK3CA
SCHEMBL2366194 0.87 KDM4E (0.36) KDM4EALDH1A1TDP1PIK3CDPIK3CA
Hydrochloric Acid SCHEMBL2365824 0.87 HTT (0.39) KDM4ELMNAHTTMAPTTSHR
SCHEMBL14687322 0.86 CFTR (0.38) KDM4EALDH1A1TDP1FASNCASP1
SCHEMBL14688015 0.86 FASN (0.39) KDM4EALDH1A1TDP1FASNCASP1
SCHEMBL14686538 0.86 MEN1 (0.41) KDM4EALDH1A1FASNCASP1HSD17B10
SCHEMBL2366456 0.86 KDM4E (0.36) KDM4EALDH1A1TDP1PIK3CDPIK3CA

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 KDM4E 1064/4885ALDH1A1 598/4885TDP1 1763/4885

“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.