SCHEMBL11737620

SCHEMBL11737620

CC(C)(Oc1ccc(COc2ccc(Br)cc2)cc1)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.72
▸ PPARA Q07869 11/20 0.67
▸ PPARD Q03181 5/20 0.67
▸ RXRA P19793 1/20 0.61
▸ RXRB P28702 1/20 0.61
▸ MAOB P27338 1/20 0.60
▸ FFAR1 O14842 1/20 0.58
▸ FFAR4 Q5NUL3 1/20 0.58

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
SCHEMBL11729678 0.88 PPARG (0.91) PPARGPPARAPPARD
SCHEMBL5795674 0.86 PPARG (0.83) PPARGPPARAPPARDMAOB
SCHEMBL1811163 0.86 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL11734207 0.85 PPARA (0.73) PPARGPPARAPPARDMAOB
SCHEMBL21991803 0.85 PPARA (0.73) PPARGPPARAPPARDMAOB
SCHEMBL11734564 0.85 PPARG (0.72) PPARGPPARAPPARDRXRARXRB
SCHEMBL11733799 0.85 PPARG (0.72) PPARGPPARAPPARDMAOB
SCHEMBL21991794 0.83 PPARA (0.77) PPARGPPARAPPARDMAOBFFAR1
SCHEMBL11602402 0.82 PPARG (0.57) PPARGPPARAPPARDRXRARXRB
SCHEMBL11753637 0.79 MAOB (0.55) PPARGPPARAPPARDRXRARXRB

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
US-3968143-A Phenoxypropionic acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-07-06 — — US claimed
US-4039683-A PHENOXYPROPIONIC ACID DERIVATIVES AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-08-02 — — US disclosed
US-3968143-A Phenoxypropionic acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-07-06 — — US disclosed
Send feedback