SCHEMBL9029922

SCHEMBL9029922

CC(CCC(C)(C)C(=O)O)Oc1ccc2c(c1)C=C(c1nccn1C)C(CCc1ccc(F)cc1F)O2

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.34
GCK P35557 1/20 0.32
PPARG P37231 1/20 0.32
ENPP2 Q13822 1/20 0.31
HTR2C P28335 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
SCHEMBL9031163 0.89 PPARG (0.37) HTR2APPARGENPP2
SCHEMBL9293255 0.87 HTR2A (0.30) HTR2AHTR2C
SCHEMBL9029914 0.83 HTR2A (0.32) HTR2APPARGHTR2C
SCHEMBL9029437 0.81 ALOX5 (0.33) PPARG
SCHEMBL9029711 0.80 PPARG (0.36) PPARG
SCHEMBL9030559 0.80
SCHEMBL9678373 0.79 HTR2A (0.32) HTR2A
SCHEMBL9029982 0.78 CHEK1 (0.36) PPARG
SCHEMBL9030891 0.76 PPARA (0.40) PPARG
SCHEMBL9676919 0.76 PPARG (0.34) PPARG

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-0513285-B1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1996-01-24 EP disclosed
US-5356920-A Anticholesterol, antilipemic agent FARMITALIA CARLO ERBA SRL. (IT) 1994-10-18 US disclosed
WO-1992009582-A1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1992-06-11 WO disclosed