SCHEMBL5275697

SCHEMBL5275697

CCCCCCCCCC(Oc1cccc(O)c1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.55
PPARG P37231 6/20 0.52
PTGES O14684 1/20 0.52
ALOX5 P09917 1/20 0.52
ALDH2 P05091 2/20 0.52
PPARA Q07869 6/20 0.51
FOLH1 Q04609 1/20 0.51
CYP3A4 P08684 1/20 0.43

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
SCHEMBL4798989 0.88 PPARG (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL570688 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL11531304 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL28763254 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL22828775 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL4001414 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL4002165 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL15903011 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL6342298 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2
SCHEMBL7553803 0.87 CTRC (0.64) CTRCPPARGPTGESALOX5ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1846364-A1 NEW POTENT AND SELECTIVE LIGANDS OF CANNABINOID RECEPTORS Universita' Degli Studi di Siena (IT) 2007-10-24 EP claimed
WO-2006080040-A1 NEW POTENT AND SELECTIVE LIGANDS OF CANNABINOID RECEPTORS UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2006-08-03 WO claimed
EP-1846364-A1 NEW POTENT AND SELECTIVE LIGANDS OF CANNABINOID RECEPTORS Universita' Degli Studi di Siena (IT) 2007-10-24 EP disclosed
WO-2006080040-A1 NEW POTENT AND SELECTIVE LIGANDS OF CANNABINOID RECEPTORS UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2006-08-03 WO disclosed