SCHEMBL8977263

SCHEMBL8977263

CCCCCc1ccc(-c2ccc3cc(CCCCCC(C)F)ccc3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.42
MAPT P10636 4/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
STAT3 P40763 1/20 0.41
ATM Q13315 1/20 0.41
SPNS2 Q8IVW8 2/20 0.39
PSMB5 P28074 1/20 0.39
DHODH Q02127 2/20 0.39
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL8911558 0.89 TLR8 (0.50) TLR8MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL7553388 0.85 KCNH2 (0.37) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL7552164 0.85 ESR1 (0.34) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL7822732 0.82 NPC1 (0.61) TLR8MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL7551168 0.81 MAPT (0.38) MAPTRAB9ASMN1; SMN2NPC1L3MBTL1
SCHEMBL6289604 0.81 TLR8 (0.55) TLR8MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL6283828 0.80 NPC1 (0.59) TLR8MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL7823855 0.80 CASP3 (0.61) TLR8MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL6290855 0.79 TLR8 (0.54) TLR8PSMB5S1PR4S1PR1S1PR5
SCHEMBL7555281 0.79 MAPT (0.42) MAPTRAB9ASMN1; SMN2NPC1L3MBTL1

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
EP-0708165-A1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-24 EP disclosed