SCHEMBL14766744

SCHEMBL14766744

CCCCOc1ccc(C2CCC(C(=O)Oc3ccc(C4CCC(OCCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.38
SCN9A Q15858 1/20 0.36
PPARD Q03181 4/20 0.35
GPR119 Q8TDV5 2/20 0.35
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
FAAH O00519 2/20 0.35
HPGD P15428 1/20 0.35
ACACB O00763 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NQO2 P16083 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
PPARA Q07869 1/20 0.34
HCRTR2 O43614 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL14765944 0.97 CRBN (0.38) CRBNSCN9APPARDGPR119RAB9A
SCHEMBL14767158 0.95 FAAH (0.39) CRBNSCN9APPARDRAB9ANPC1
SCHEMBL14766064 0.94 PPARD (0.37) CRBNSCN9APPARDGPR119FAAH
SCHEMBL14767288 0.93 FAAH (0.40) CRBNSCN9APPARDRAB9ANPC1
SCHEMBL14766278 0.91 CRBN (0.35) CRBNSCN9APPARDGPR119RAB9A
SCHEMBL14766016 0.91 SCN9A (0.35) CRBNSCN9APPARDGPR119RAB9A
SCHEMBL12737253 0.91 CRBN (0.39) CRBNSCN9APPARDRAB9ANPC1
SCHEMBL14766175 0.90 SCN9A (0.38) SCN9APPARDRAB9ANPC1HPGD
SCHEMBL14767164 0.90 SCN9A (0.38) SCN9APPARDRAB9ANPC1HPGD
SCHEMBL14767131 0.90 SCN9A (0.39) CRBNSCN9APPARDGPR119RAB9A

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
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed