SCHEMBL14766271

SCHEMBL14766271

CCCCOC1CCC(c2ccc(OC(=O)C3CCC(c4ccc(OCC)c(F)c4F)CC3)c(F)c2F)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.40
SCN9A Q15858 1/20 0.36
HCRTR2 O43614 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
PPARD Q03181 2/20 0.34
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ACACB O00763 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GLA P06280 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL14767046 1.00 HPGD (0.40) HPGDSCN9AHCRTR2SMN1; SMN2PPARD
SCHEMBL14767123 0.97 SCN9A (0.38) HPGDSCN9AHCRTR2SMN1; SMN2PPARD
SCHEMBL14766229 0.97 SCN9A (0.38) HPGDSCN9AHCRTR2SMN1; SMN2PPARD
SCHEMBL14767164 0.94 SCN9A (0.38) HPGDSCN9AHCRTR2SMN1; SMN2PPARD
SCHEMBL14766175 0.94 SCN9A (0.38) HPGDSCN9AHCRTR2SMN1; SMN2PPARD
SCHEMBL14922562 0.94 HPGD (0.42) HPGDSCN9ASMN1; SMN2PPARDRAB9A
SCHEMBL14922670 0.91 SCN9A (0.41) HPGDSCN9ASMN1; SMN2PPARDRAB9A
SCHEMBL14766070 0.91 HPGD (0.39) HPGDSCN9AHCRTR2PPARDRAB9A
SCHEMBL14766064 0.90 PPARD (0.37) HPGDSCN9AHCRTR2PPARD
SCHEMBL14767153 0.90 HPGD (0.35) HPGDSCN9AHCRTR2SMN1; SMN2RAB9A

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