SCHEMBL9005908

SCHEMBL9005908

Cc1oc(-c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)nc1CCOc1ccc(CN(O)C(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.53
PPARG P37231 18/20 0.53
PPARD Q03181 3/20 0.49

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
SCHEMBL8859196 0.84 PPARG (0.72) PPARAPPARGPPARD
SCHEMBL9156966 0.84 PPARA (0.61) PPARAPPARGPPARD
SCHEMBL9005936 0.83 PPARG (0.64) PPARAPPARG
SCHEMBL9005900 0.83 PPARG (0.60) PPARAPPARGPPARD
Hydrochloric Acid SCHEMBL6966815 0.83 PPARG (0.49) PPARAPPARGPPARD
SCHEMBL9005899 0.82 PPARA (0.58) PPARAPPARG
SCHEMBL6964821 0.80 PPARA (0.52) PPARAPPARGPPARD
SCHEMBL9005933 0.80 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL9005916 0.78 PPARG (0.73) PPARAPPARG
Hydrochloric Acid SCHEMBL6966812 0.78 PPARG (0.47) PPARAPPARGPPARD

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
US-5541205-A ANTIINFLAMMATORY AGENTS; ANTIASTHMA AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-07-30 US claimed
US-5428048-A Aryl-N-hydroxyureas as inhibitors of 5-lipoxygenase and anto-arteriosclerotic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1995-06-27 US claimed