SCHEMBL14767247

SCHEMBL14767247

C=CCCOc1ccc(OC(=O)C2CCC(c3ccc(C4CCC(OCCCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.35
SCN9A Q15858 1/20 0.35
CRBN Q96SW2 1/20 0.35
HPGD P15428 3/20 0.34
PPARD Q03181 5/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
ACACB O00763 1/20 0.32
SLC10A2 Q12908 1/20 0.32
PPARG P37231 2/20 0.32
FFAR1 O14842 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PPARA Q07869 1/20 0.32
PTGES O14684 1/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL14766978 0.97 FAAH (0.36) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14766016 0.96 SCN9A (0.35) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14767172 0.94 HPGD (0.35) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14766278 0.93 CRBN (0.35) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14767149 0.93 SCN9A (0.37) FAAHSCN9ACRBNHPGDACACB
SCHEMBL14767288 0.93 FAAH (0.40) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14767239 0.91 SCN9A (0.36) FAAHSCN9ACRBNHPGDPPARD
SCHEMBL14767053 0.91 SCN9A (0.36) SCN9AHPGDACACBNPC1ALDH1A1
SCHEMBL14766474 0.91 SCN9A (0.36) SCN9AHPGDACACBNPC1ALDH1A1
SCHEMBL14767192 0.90 PPARD (0.38) FAAHSCN9ACRBNHPGDPPARD

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