SCHEMBL6932706

SCHEMBL6932706

C/C=C/CCCCCCC(CCCCCCC(F)(F)C(F)(F)F)(C(=O)O)C1c2ccc(OCOC)cc2OCC1(C)c1ccc(OCOC)cc1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.30
PPARG P37231 1/20 0.30
PPARD Q03181 1/20 0.30

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
SCHEMBL6932709 1.00 FFAR1 (0.30) FFAR1PPARGPPARD
SCHEMBL7813287 0.91
SCHEMBL6938180 0.90 PPARG (0.32) FFAR1PPARGPPARD
SCHEMBL6938280 0.90 PPARG (0.32) FFAR1PPARGPPARD
SCHEMBL6935689 0.80
SCHEMBL7085013 0.80 ESR1 (0.33)
SCHEMBL7085015 0.80 ESR1 (0.33)
SCHEMBL5855328 0.78
SCHEMBL6938216 0.78 CYP3A4 (0.30)
SCHEMBL7812643 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240156-A4 3-METHYL-CHROMANE OR THIOCHROMANE DERIVATIVES CHUGAI PHARMACEUTICAL CO LTD (JP) 2003-04-16 EP disclosed
EP-1240156-A1 3-METHYL-CHROMANE OR THIOCHROMANE DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-09-18 EP disclosed
WO-2001042237-A1 3-METHYL-CHROMANE OR THIOCHROMANE DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-06-14 WO disclosed