SCHEMBL6676707

SCHEMBL6676707

CCCCCOC(CC)C(OCCCCC)Oc1ccc(Br)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
KDR P35968 1/20 0.31
HPGD P15428 1/20 0.31
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
LPAR2 Q9HBW0 1/20 0.31
AAK1 Q2M2I8 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
SCHEMBL6655191 1.00 SLC6A4 (0.39) SLC6A4SMN1; SMN2NPSR1CYSLTR2CYSLTR1
SCHEMBL6656930 0.79 MGLL (0.37) NPC1LMNARAB9A
SCHEMBL6656248 0.79 MGLL (0.37) NPC1LMNARAB9A
SCHEMBL7915947 0.78 SLC6A4 (0.39) SLC6A4THRATHRB
SCHEMBL6659358 0.77 L3MBTL1 (0.36)
SCHEMBL6687682 0.76 SMN1; SMN2 (0.50) SMN1; SMN2NPSR1CYSLTR2CYSLTR1THRA
SCHEMBL8751850 0.75 THRA (0.51) SMN1; SMN2NPSR1CYSLTR2CYSLTR1THRA
SCHEMBL8216926 0.75 THRA (0.51) SMN1; SMN2NPSR1CYSLTR2CYSLTR1THRA
SCHEMBL8751890 0.75 THRA (0.51) SMN1; SMN2NPSR1CYSLTR2CYSLTR1THRA
SCHEMBL8751869 0.75 THRA (0.51) SMN1; SMN2NPSR1CYSLTR2CYSLTR1THRA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1160233-B1 Novel terphenyl compounds SHARP KK (JP) 2004-07-21 EP disclosed
EP-1160233-A2 Novel terphenyl compounds SHARP KABUSHIKI KAISHA (JP) 2001-12-05 EP disclosed