SCHEMBL95395

SCHEMBL95395

[CH2]c1ccc(C(=O)Nc2cccc(Oc3ccccc3)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.68
HPSE Q9Y251 1/20 0.65
PLAU P00749 1/20 0.63
GALK1 P51570 1/20 0.62
CASP6 P55212 1/20 0.62
MCL1 Q07820 1/20 0.62
PLEC Q15149 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
RAB9A P51151 4/20 0.61
NPC1 O15118 3/20 0.61
NLRP3 Q96P20 1/20 0.61
TRPV1 Q8NER1 1/20 0.59
PGR P06401 2/20 0.59
KMT2A Q03164 3/20 0.57
ALDH1A1 P00352 2/20 0.57
TP53 P04637 2/20 0.57
PKM P14618 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KCNK9 Q9NPC2 3/20 0.57
KCNK3 O14649 2/20 0.57

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
SCHEMBL22543145 0.90 NR1H4 (0.78) NR1H4HPSEPLAUGALK1CASP6
SCHEMBL22542833 0.88 GALK1 (0.76) NR1H4HPSEPLAUGALK1CASP6
SCHEMBL94749 0.87 PGR (0.79) NR1H4RAB9ANPC1PGRKMT2A
SCHEMBL94247 0.87 PGR (0.79) NR1H4RAB9ANPC1PGRKMT2A
SCHEMBL26323900 0.86 NR1H4 (0.68) NR1H4HPSEPLAUGALK1CASP6
SCHEMBL94989 0.86 PGR (0.68) NR1H4RAB9ANPC1PGRKMT2A
SCHEMBL13211973 0.86 NR1H4 (0.68) NR1H4HPSEPLAUGALK1CASP6
SCHEMBL94789 0.84 NPC1 (0.81) PLAURAB9ANPC1NLRP3TRPV1
SCHEMBL12201930 0.83 KCNK9 (0.74) NR1H4HPSEPLAUGALK1CASP6
SCHEMBL19860068 0.82 NR1H4 (0.64) NR1H4HPSEPLAUGALK1CASP6

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 14 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-2007119600-A9 CARBAZOLE COMPOUND OTSUKA PHARMA CO LTD (JP) 2008-05-02 WO disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 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 NR1H4 1771/4885HPSE 4872/4885PLAU 4751/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 NR1H4 1462/4885HPSE 4690/4885PLAU 4430/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 NR1H4 1462/4885HPSE 4690/4885PLAU 4430/4885

“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.