SCHEMBL13598446

SCHEMBL13598446

COc1ccc(CC2SC(=O)NC2=O)c2c1N(Cc1ccc(OCc3ccccc3)cc1)C(=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 13/20 0.47
▸ PPARA Q07869 5/20 0.46
▸ CA2 P00918 1/20 0.46
▸ PPARG P37231 5/20 0.44
▸ PTPN1 P18031 1/20 0.42
▸ MPC2 O95563 1/20 0.40
▸ CYP2C8 P10632 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40

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
SCHEMBL98551 0.90 FFAR1 (0.42) FFAR1PPARACA2PPARGPTPN1
SCHEMBL13602443 0.89 CA2 (0.48) FFAR1PPARACA2PPARGPTPN1
SCHEMBL95205 0.89 CA2 (0.45) FFAR1PPARACA2PPARGPTPN1
SCHEMBL94894 0.86 CA2 (0.47) FFAR1CA2PPARGPTPN1
SCHEMBL13598457 0.86 TGM2 (0.39) FFAR1CA2PTPN1
SCHEMBL95070 0.86 CA2 (0.48) FFAR1CA2PPARGPTPN1MPC2
SCHEMBL98093 0.86 CA2 (0.45) FFAR1CA2PPARGPTPN1MPC2
SCHEMBL95913 0.86 CA2 (0.46) FFAR1PPARACA2PPARGPTPN1
SCHEMBL95628 0.86 MAPT (0.47) FFAR1CA2PPARGPTPN1MPC2
SCHEMBL97563 0.85 CA2 (0.40) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 — — 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 (1 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 FFAR1 2284/4885PPARA 3385/4885CA2 823/4885

“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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