SCHEMBL7844834

SCHEMBL7844834

CON=C(C)c1ccc(F)c(Cl)c1.CON=CCc1cc(F)ccc1F.CON=CCc1ccc(Cl)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
S1PR3 Q99500 1/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 0.31
DRD4 P21917 2/20 0.31
DRD2 P14416 1/20 0.31
SLC6A4 P31645 3/20 0.30
HTR2A P28223 2/20 0.30
KCNH2 Q12809 2/20 0.30
LMNA P02545 1/20 0.30
PTBP1 P26599 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7782583 0.91 RAB9A (0.39) KDM4EMAPTRAB9ASLC6A4HTR2A
SCHEMBL7570658 0.85 RAB9A (0.34) RAB9ASLC6A4HTR2AKCNH2LMNA
SCHEMBL7868306 0.83
SCHEMBL7868617 0.78 S1PR1 (0.34) RAB9AS1PR3SLC6A4
SCHEMBL7866868 0.76 IDO1 (0.31)
SCHEMBL7844833 0.75 RAB9A (0.42) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL7784388 0.75 NPFFR2 (0.37) S1PR3LMNA
SCHEMBL6819179 0.74 MAPT (0.48) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL6819174 0.74 MAPT (0.48) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL6811369 0.71 SLC6A4 (0.45) KDM4EALDH1A1MAPTHPGDRAB9A

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