SCHEMBL97436

SCHEMBL97436

CCCCCc1cccc(CCCCC=O)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
LPL P06858 3/20 0.51
LIPG Q9Y5X9 3/20 0.51
PPARA Q07869 5/20 0.51
PPARG P37231 2/20 0.50
TRPV1 Q8NER1 2/20 0.47
FAAH O00519 2/20 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
SCHEMBL5252891 0.95 PPARA (0.50) TSHRLPLLIPGPPARAPPARG
SCHEMBL8827726 0.91 TSHR (0.46) TSHRLPLLIPGPPARAPPARG
SCHEMBL22320003 0.87 TSHR (0.41) TSHRLPLLIPGPPARAPPARG
SCHEMBL7350183 0.85 PPARA (0.62) PPARAPPARG
SCHEMBL8518305 0.84 LPL (0.66) LPLLIPGPPARAPPARG
SCHEMBL97939 0.83 TSHR (0.64) TSHRLPLLIPGTRPV1FAAH
SCHEMBL8827593 0.83 TSHR (0.64) TSHRLPLLIPGTRPV1FAAH
SCHEMBL5249436 0.82 LPL (0.67) LPLLIPGPPARAPPARG
SCHEMBL4032533 0.82 LPL (0.67) LPLLIPGPPARAPPARG
SCHEMBL6932623 0.82 LPL (0.67) LPLLIPGPPARAPPARG

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 7 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
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 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 (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 TSHR 3439/4885LPL 4238/4885LIPG 4374/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 TSHR 110/4885LPL 2580/4885LIPG 3243/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 TSHR 110/4885LPL 2580/4885LIPG 3243/4885

“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.