SCHEMBL95049

SCHEMBL95049

CCCC(=O)c1cccc(C=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UNG P13051 1/20 0.58
HPGD P15428 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HSD17B3 P37058 1/20 0.46
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 6/20 0.40
RAB9A P51151 4/20 0.39
MAPT P10636 3/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 1/20 0.39
NPC1 O15118 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL25755293 0.87 UNG (0.51) UNGL3MBTL1HSD17B3CES2CES1
SCHEMBL8581009 0.83 L3MBTL1 (0.51) UNGHPGDSMN1; SMN2L3MBTL1HSD17B3
SCHEMBL29153730 0.83 HSD17B3 (0.57) HPGDSMN1; SMN2L3MBTL1HSD17B3CES2
SCHEMBL10881897 0.82 HPGD (0.42) UNGHPGDSMN1; SMN2L3MBTL1HSD17B3
SCHEMBL26012364 0.82 UNG (0.53) UNGHPGDTRIM24TRIM33ALDH1A1
SCHEMBL3614748 0.81 KDM4E (0.55) HPGDSMN1; SMN2L3MBTL1ALDH1A1NPSR1
SCHEMBL3614745 0.81 KDM4E (0.55) HPGDSMN1; SMN2L3MBTL1ALDH1A1NPSR1
SCHEMBL9586730 0.80 UNG (0.63) UNGTRIM24TRIM33ALDH1A1RAB9A
SCHEMBL19116947 0.79 UNG (0.61) UNGL3MBTL1TRIM24TRIM33ALDH1A1
SCHEMBL12944157 0.79 UNG (0.61) UNGTRIM24TRIM33ALDH1A1FFAR1

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 11 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
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 UNG 4458/4885HPGD 2146/4885SMN1; SMN2 3998/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 UNG 4503/4885HPGD 2322/4885SMN1; SMN2 3084/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 UNG 4503/4885HPGD 2322/4885SMN1; SMN2 3084/4885

“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.