SCHEMBL5959429

SCHEMBL5959429

CSc1cccc(-c2ccc(C(=CCOc3ccc(OCC(=O)O)cc3)c3ccc(-c4cccc(SC)c4)cc3)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 14/20 0.48
▸ PPARG P37231 7/20 0.48
▸ PPARA Q07869 6/20 0.48
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ LMNA P02545 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ FFAR1 O14842 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ PKM P14618 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
SCHEMBL5959789 0.90 PPARD (0.55) PPARDPPARGPPARAFFAR1
SCHEMBL5959607 0.89 PPARD (0.49) PPARDPPARGPPARAFFAR1
SCHEMBL5959489 0.89 PPARD (0.50) PPARDPPARGPPARAALDH1A1HPGD
SCHEMBL5959525 0.85 FFAR1 (0.51) PPARDPPARGPPARALMNAMAPT
SCHEMBL5959551 0.85 PPARD (0.59) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL6428168 0.85 PPARD (0.49) PPARDPPARGPPARALMNASMN1; SMN2
SCHEMBL5959644 0.84 LMNA (0.54) PPARDPPARGPPARAALDH1A1HPGD
SCHEMBL5959392 0.84 PPARD (0.54) PPARDPPARGPPARAALDH1A1HPGD
SCHEMBL5959352 0.83 PPARD (0.48) PPARDPPARGPPARAALDH1A1HPGD
SCHEMBL5959510 0.83 PPARD (0.48) PPARDPPARGPPARAFFAR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091245-B2 Compounds, their preparation and use NOVO NOVDISK A/S (DK) 2006-08-15 — — US claimed
US-20040143006-A1 Novel compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2004-07-22 — — US claimed
US-7091245-B2 Compounds, their preparation and use NOVO NOVDISK A/S (DK) 2006-08-15 — — US disclosed
EP-1537076-A1 NOVEL VINYL CARBOXYLIC ACID DERIVATIVES AND THEIR THERAPEUTICAL USE NOVO NORDISK A/S (DK) 2005-06-08 — — EP disclosed
US-20040143006-A1 Novel compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2004-07-22 — — US disclosed
WO-2004022533-A1 NOVEL VINYL CARBOXYLIC ACID DERIVATIVES AND THEIR THERAPEUTICAL USE NOVO NORDISK A/S (DK) 2004-03-18 — — 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 (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-20040143006-A1 Novel compounds, their preparation and use PPARG, PPARD, PPARA PPARD 2/4885PPARG 1/4885PPARA 3/4885

“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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