SCHEMBL14765944

SCHEMBL14765944

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

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.38
SCN9A Q15858 1/20 0.37
PPARD Q03181 5/20 0.36
FAAH O00519 3/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PPARA Q07869 2/20 0.34
GPR119 Q8TDV5 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
HCRTR2 O43614 1/20 0.34
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
ACACB O00763 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
SCHEMBL14766744 0.97 CRBN (0.38) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14766064 0.97 PPARD (0.37) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14767288 0.95 FAAH (0.40) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14766278 0.94 CRBN (0.35) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14766016 0.93 SCN9A (0.35) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14767192 0.93 PPARD (0.38) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14767158 0.93 FAAH (0.39) CRBNSCN9APPARDFAAHHPGD
SCHEMBL12737253 0.91 CRBN (0.39) CRBNSCN9APPARDFAAHHPGD
SCHEMBL14767123 0.90 SCN9A (0.38) SCN9APPARDHPGDRAB9ANPC1
SCHEMBL14766229 0.90 SCN9A (0.38) SCN9APPARDHPGDRAB9ANPC1

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