SCHEMBL7845167

SCHEMBL7845167

CON=CC(=NOC)c1ccc(F)cc1F.CON=CCc1ccc(C(F)(F)F)c(F)c1.CON=CCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
HTR1A P08908 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL7866868 0.81 IDO1 (0.31)
SCHEMBL7784388 0.79 NPFFR2 (0.37) GPR183MEN1NPC1KMT2A
SCHEMBL7868617 0.78 S1PR1 (0.34) GPR183MEN1NPC1KMT2ASLC6A2
SCHEMBL7872121 0.75 CES2 (0.42)
SCHEMBL7868613 0.67 NPFFR2 (0.38) MEN1KMT2A
SCHEMBL7860588 0.67 IDO1 (0.36) MEN1KMT2A
SCHEMBL7872120 0.66 DDR1 (0.36) NPC1KMT2ASLC6A4
SCHEMBL7844834 0.65 GCGR (0.33) SLC6A4
SCHEMBL7785246 0.64 SLC6A4 (0.34) NPC1KMT2ASLC6A4
SCHEMBL7784385 0.63 NPFFR2 (0.45) MEN1KMT2ASLC6A4

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-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed