SCHEMBL8573121

SCHEMBL8573121

CCCCCCCC=Cc1ccc(-c2ncc(CCCCCC(C)O)cn2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.37
ASAH2 Q9NR71 1/20 0.36
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LTB4R Q15722 1/20 0.32
FAAH O00519 1/20 0.32
PTGIR P43119 1/20 0.32
PPARA Q07869 1/20 0.32
NPC1 O15118 1/20 0.31
STAT3 P40763 1/20 0.31
ATM Q13315 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
SCHEMBL8665778 1.00 RARB (0.37) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL8569442 0.91 RARB (0.35) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL8667524 0.91 RARB (0.35) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7510141 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7511695 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7513414 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7513419 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7509223 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7510133 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2
SCHEMBL7509214 0.91 RARB (0.41) RARBASAH2MAPTRAB9ASMN1; SMN2

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-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed