SCHEMBL2546072

SCHEMBL2546072

CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N3C(=O)OCC3COC(=O)c3ccccc3)cc2S(C)(=O)=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 2/20 0.41
ALDH1A1 P00352 1/20 0.39
TGFBR1 P36897 1/20 0.38
GPR119 Q8TDV5 4/20 0.37
TP53 P04637 3/20 0.36
THRB P10828 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ABCB1 P08183 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA5 P30532 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
POLB P06746 1/20 0.35
ATM Q13315 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
SCHEMBL2365745 1.00 NR1H2 (0.41) NR1H2NR1H3ALDH1A1TGFBR1GPR119
SCHEMBL2366690 0.90 TP53 (0.39) ALDH1A1TGFBR1TP53THRBKDM4E
SCHEMBL2366697 0.90 TP53 (0.39) ALDH1A1TGFBR1TP53THRBKDM4E
SCHEMBL2365654 0.88 GPR119 (0.40) NR1H2NR1H3GPR119LMNAMAPT
SCHEMBL2365659 0.88 GPR119 (0.40) NR1H2NR1H3GPR119LMNAMAPT
SCHEMBL2365882 0.86 GPR119 (0.41) NR1H2NR1H3GPR119TP53THRB
SCHEMBL2365872 0.86 GPR119 (0.41) NR1H2NR1H3GPR119TP53THRB
SCHEMBL2366863 0.86 ALDH1A1 (0.47) ALDH1A1TGFBR1GPR119KDM4EPKM
SCHEMBL2366857 0.86 ALDH1A1 (0.47) ALDH1A1TGFBR1GPR119KDM4EPKM
SCHEMBL2366171 0.83 MGLL (0.44)

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 3 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-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-27 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-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP2 NR1H2 2761/4885NR1H3 3146/4885ALDH1A1 598/4885

“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.