SCHEMBL7730882

SCHEMBL7730882

CCc1ccc(C(F)(F)Oc2ccc(C(F)(F)Oc3ccc(OC(F)F)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.39
PPARA Q07869 3/20 0.39
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
HTT P42858 1/20 0.35
EPHX1 P07099 1/20 0.35
RXRA P19793 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALOX15 P16050 1/20 0.35
GFER P55789 1/20 0.35
ADAM17 P78536 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL7730604 1.00 PPARG (0.39) PPARGPPARALMNAPOLBTSHR
SCHEMBL7730388 0.96 DAO (0.40) PPARGPPARALMNAPOLBTSHR
SCHEMBL7735170 0.88 TSHR (0.44) PPARGPPARALMNATSHREPHX2
SCHEMBL14749515 0.88 TSHR (0.44) PPARGPPARALMNATSHREPHX2
SCHEMBL7732775 0.88 PPARG (0.40) PPARGPPARALMNAPOLBMAPK1
SCHEMBL7731001 0.88 PPARG (0.40) PPARGPPARALMNAPOLBMAPK1
SCHEMBL7729751 0.87 DAO (0.40) PPARGPPARALMNAPOLBMAPK1
SCHEMBL7730399 0.85 PPARA (0.38) PPARALMNAPOLBMAPK1ALDH1A1
SCHEMBL7733320 0.85 PPARA (0.38) PPARALMNAPOLBMAPK1ALDH1A1
SCHEMBL7730268 0.85 TSHR (0.49) PPARGPPARALMNATSHREPHX2

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-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed