Sugi Predict

Sugi Predict / Compounds / SCHEMBL5505559

SCHEMBL5505559

SCHEMBL5505559

Cc1cccc2c(-c3cccc(NCc4ccc(CC(=O)O)cc4)c3)c(-c3ccccc3)nnc12.Nc1cccc(-c2c(-c3ccccc3)nnc3c(Cl)cccc23)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 20/20 0.59
▸ NR1H3 Q13133 18/20 0.59
▸ PPARG P37231 3/20 0.59
▸ PPARD Q03181 3/20 0.59
▸ PPARA Q07869 3/20 0.59

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
SCHEMBL3279593 0.90 NR1H2 (0.68) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL3279917 0.90 NR1H2 (0.69) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL3278045 0.83 NR1H2 (0.57) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL5505556 0.82 NR1H2 (0.53) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL3280109 0.82 NR1H2 (0.59) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL3279446 0.79 NR1H2 (0.58) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL28769033 0.79 NR1H2 (0.56) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL5507436 0.79 NR1H2 (0.58) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL5508555 0.78 NR1H2 (0.56) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL3280350 0.77 NR1H2 (0.64) NR1H2NR1H3PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1853566-A1 CINNOLINE COMPOUNDS AND THEIR USE AS LIVER X RECEPTOR MODULATORS Wyeth (US) 2007-11-14 — — EP claimed
WO-2006094034-A1 CINNOLINE COMPOUNDS AND THEIR USE AS LIVER X RECEPTOR MODILATORS WYETH (US) 2006-09-08 — — WO claimed