SCHEMBL9014343

SCHEMBL9014343

Fc1cc(Br)cc(F)c1C(F)(F)F.[MgH2]

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
DGAT1 O75907 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
SCHEMBL584943 0.97 DAO (0.34) DAOCYP11B1CYP11B2DGAT1
SCHEMBL15627263 0.83 CYP11B1 (0.36) CYP11B1CYP11B2
SCHEMBL13550081 0.81 PTGS2 (0.30)
SCHEMBL30047939 0.81 DGAT1 (0.31) DGAT1
SCHEMBL28906499 0.81 DGAT1 (0.31) DGAT1
SCHEMBL22444782 0.81 NMT1 (0.33)
SCHEMBL18099485 0.81 DGAT1 (0.31) DGAT1
SCHEMBL21081880 0.81 TRPV4 (0.45)
SCHEMBL2395180 0.80
SCHEMBL20638975 0.77 ERN1 (0.36)

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-0568040-B1 Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORP (JP) 1996-12-04 EP disclosed
US-5468421-A Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1995-11-21 US disclosed
EP-0568040-A1 Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1993-11-03 EP disclosed