SCHEMBL95632

SCHEMBL95632

[CH2]c1ccc(C(=O)N(Cc2ccccc2)C2CCCCC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AGER Q15109 3/20 0.76
MTNR1A P48039 1/20 0.76
CHRM2 P08172 1/20 0.57
CHRM3 P20309 1/20 0.57
ALDH1A1 P00352 4/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 2/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SLC6A9 P48067 4/20 0.49
SLC6A5 Q9Y345 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NSD2 O96028 1/20 0.46

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
SCHEMBL1169839 0.86 AGER (1.00) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL2814615 0.81 AGER (0.67) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL96038 0.80 HSD11B1 (0.62) AGERMTNR1AMEN1KMT2ALMNA
SCHEMBL94490 0.76 AGER (0.45) AGERMTNR1AALDH1A1MEN1KMT2A
SCHEMBL13503843 0.76 CHRM2 (0.65) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL18290474 0.75 AGER (0.60) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL13505631 0.75 AGER (0.60) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL23175993 0.74 AGER (0.63) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL7011050 0.74 AGER (0.58) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL4139952 0.74 L3MBTL1 (0.62) AGERMTNR1AALDH1A1MEN1KMT2A

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 AGER 3852/4885MTNR1A 1110/4885CHRM2 3353/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 AGER 966/4885MTNR1A 460/4885CHRM2 370/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 AGER 966/4885MTNR1A 460/4885CHRM2 370/4885

“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.