SCHEMBL94429

SCHEMBL94429

[CH2]c1ccc(C(=O)N2CCC(N(C)c3ccc(Cl)cc3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.56
MGLL Q99685 10/20 0.52
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.49
CYP3A4 P08684 1/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
LSS P48449 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HSD11B1 P28845 1/20 0.47

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
SCHEMBL94863 0.78 MGLL (0.86) MGLLMAPTKMT2AMEN1HSD11B1
SCHEMBL94921 0.74 GAA (0.56) MGLLMAPTKMT2AMEN1HSD11B1
SCHEMBL25391302 0.73 MEN1 (0.67) MAPTKMT2AMEN1L3MBTL1
SCHEMBL94743 0.73 L3MBTL3 (0.57) L3MBTL3L3MBTL1
SCHEMBL154347 0.73 ALDH1A1 (0.71) MGLLMAPTPOLBKMT2AMEN1
SCHEMBL11007666 0.72 MGLL (0.71) MGLLMAPTPOLBKMT2AMEN1
SCHEMBL2056120 0.72 HTR2A (0.56) POLBLSSL3MBTL1
SCHEMBL306320 0.72 GRM5 (0.60) L3MBTL3MGLLMAPTKMT2AMEN1
SCHEMBL10722382 0.71 POLB (0.81) MGLLMAPTPOLBKMT2A
SCHEMBL9585721 0.71 POLB (0.81) MGLLMAPTPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
CN-101489555-A Nf-kappa OTSUKA PHARMA CO LTD (JP) 2009-07-22 CN disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 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 (3 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB L3MBTL3 1998/4885MGLL 3702/4885MAPT 4112/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 L3MBTL3 889/4885MGLL 1523/4885MAPT 4773/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 L3MBTL3 889/4885MGLL 1523/4885MAPT 4773/4885

“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.