SCHEMBL9066210

SCHEMBL9066210

COc1c(C2=C([Zr])CC=C2)cc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RARG P13631 1/20 0.32
RXRA P19793 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL9066005 0.82 RARG (0.31) RARGRXRAPPARG
Hydrochloric Acid SCHEMBL9066459 0.81 RARG (0.31) RARGRXRAPPARG
SCHEMBL14817161 0.77 RARG (0.40) RARGRXRAPPARG
Hydrochloric Acid SCHEMBL9066684 0.75
SCHEMBL9066853 0.75
SCHEMBL2947022 0.71 PTGS2 (0.47) RARGRXRAPPARG
SCHEMBL9343617 0.70 RARG (0.32) RARGRXRAPPARG
SCHEMBL17274610 0.68 HSP90AA1 (0.50) RARGRXRAPPARG
SCHEMBL5085856 0.68
Hydrochloric Acid SCHEMBL9067189 0.67 PTGS2 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540108-B1 Catalyst composition SHELL INT RESEARCH (NL) 1996-01-03 EP claimed