SCHEMBL8804128

SCHEMBL8804128

Fc1cccc(F)c1-c1nsc(S)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
LMNA P02545 2/20 0.34
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
TTR P02766 1/20 0.32
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
BACE1 P56817 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PRNP P04156 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL8805753 0.88 PTGES (0.38) NPC1RAB9ALMNACASP3SENP8
SCHEMBL9866354 0.79 MPL (0.40) NPC1RAB9AL3MBTL1SMN1; SMN2KDM4E
SCHEMBL18377841 0.77 ADORA3 (0.53) NPC1RAB9ALMNACASP3SENP8
SCHEMBL8803518 0.73 KDM4E (0.42) KDM4EMEN1GAAKMT2A
SCHEMBL8947073 0.72 TTR (0.46) NPC1RAB9ATTRPIM1PIM3
SCHEMBL2213825 0.69 ADORA3 (0.59) NPC1RAB9ALMNACASP3SENP8
SCHEMBL23042515 0.69 RAB9A (0.50) NPC1RAB9ALMNACASP3SENP7
SCHEMBL8805859 0.69 IDH1 (0.38) NPC1RAB9ALMNACASP3SENP8
SCHEMBL6529431 0.67 PSMD14 (0.30)
SCHEMBL6530965 0.67 CCR1 (0.52)

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-0751943-A1 TRIAZOLE COMPOUNDS AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 1997-01-08 EP disclosed
WO-1995025107-A1 TRIAZOLE COMPOUNDS AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1995-09-21 WO disclosed