SCHEMBL5698974

SCHEMBL5698974

FCOc1ccccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
MRGPRX4 Q96LA9 1/20 0.46
PPARG P37231 1/20 0.42
IDO1 P14902 2/20 0.42
NOTUM Q6P988 1/20 0.42
LTA4H P09960 1/20 0.42
PTGS2 P35354 1/20 0.42
DRD2 P14416 5/20 0.40
MCL1 Q07820 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
SSTR4 P31391 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SSTR1 P30872 1/20 0.38
RBP4 P02753 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL18833336 0.83 RXRA (0.47) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL28060228 0.83 RXRA (0.50) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL535975 0.81 RXRA (0.49) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL21722981 0.81 RXRA (0.49) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL31035275 0.81 ALDH1A1 (0.50) RXRARXRBRXRGMRGPRX4DRD2
SCHEMBL2095584 0.81 RXRA (0.53) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL11840784 0.81 RXRA (0.49) RXRARXRBRXRGMRGPRX4PPARG
SCHEMBL13253653 0.81 CYP1A2 (0.51) RXRARXRBRXRGDRD1
SCHEMBL6946500 0.81 ALDH1A1 (0.50) RXRARXRBRXRGMRGPRX4DRD2
SCHEMBL2095578 0.81 RXRA (0.53) RXRARXRBRXRGMRGPRX4PPARG

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
EP-1675814-A1 PHENOXYETHER DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-07-05 EP disclosed
WO-2005037763-A1 PHENOXYETHER DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-04-28 WO disclosed