SCHEMBL98551

SCHEMBL98551

O=C1NC(=O)C(Cc2ccc(OCc3ccccc3)c3c2CCC(=O)N3Cc2ccccc2)S1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 12/20 0.42
▸ PPARA Q07869 3/20 0.41
▸ CA2 P00918 1/20 0.38
▸ PPARG P37231 5/20 0.38
▸ PTPN1 P18031 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL13598446 0.90 FFAR1 (0.47) FFAR1PPARACA2PPARGPTPN1
SCHEMBL97563 0.89 CA2 (0.40) FFAR1PPARACA2PPARGPTPN1
SCHEMBL98016 0.85 PPARG (0.41) FFAR1PPARACA2PPARG
SCHEMBL95205 0.85 CA2 (0.45) FFAR1PPARACA2PPARGPTPN1
SCHEMBL13598457 0.82 TGM2 (0.39) FFAR1CA2PTPN1
SCHEMBL94894 0.81 CA2 (0.47) FFAR1CA2PPARGPTPN1HPGD
SCHEMBL98093 0.81 CA2 (0.45) FFAR1CA2PPARGPTPN1
SCHEMBL95628 0.81 MAPT (0.47) FFAR1CA2PPARGPTPN1HPGD
SCHEMBL95913 0.81 CA2 (0.46) FFAR1PPARACA2PPARGPTPN1
SCHEMBL13602443 0.80 CA2 (0.48) FFAR1PPARACA2PPARGPTPN1

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 8 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-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 (2 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-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 FFAR1 505/4885PPARA 1465/4885CA2 254/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 FFAR1 505/4885PPARA 1465/4885CA2 254/4885

“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.

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