SCHEMBL28035154

SCHEMBL28035154

FC(F)(F)c1ccc(I)c(CCl)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
PTPN5 P54829 1/20 0.34
NOTUM Q6P988 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTR2A P28223 3/20 0.33
SLC6A4 P31645 3/20 0.33
KCNH2 Q12809 3/20 0.33
PDE2A O00408 2/20 0.33
HSD17B10 Q99714 1/20 0.33
CES2 O00748 2/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
DAO P14920 1/20 0.32
CYBB P04839 1/20 0.32
NOX3 Q9HBY0 1/20 0.32
NOX4 Q9NPH5 1/20 0.32
NOX1 Q9Y5S8 1/20 0.32

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
SCHEMBL11537101 0.81 IDO1 (0.43) IDO1PTPN5CYP3A4CYP2D6HTR2A
SCHEMBL531384 0.80 KLF10 (0.40) IDO1PTPN5NOTUMCYP3A4CYP2D6
SCHEMBL532671 0.80 IDO1 (0.40) IDO1PTPN5CYP3A4CYP2D6HTR2A
SCHEMBL12650016 0.80 ESR1 (0.40) IDO1PTPN5CYP3A4CYP2D6HTR2A
SCHEMBL5436712 0.78 SLC6A4 (0.43) IDO1CYP3A4HTR2ASLC6A4KCNH2
SCHEMBL3188993 0.78 CES2 (0.46) IDO1PTPN5CYP3A4CYP2D6PDE2A
SCHEMBL16758990 0.78 IDO1 (0.58) IDO1PTPN5HTR2ASLC6A4KCNH2
SCHEMBL531423 0.77 PTPN1 (0.38) IDO1PTPN5CYP3A4CYP2D6HTR2A
SCHEMBL2111621 0.76 IDO1 (0.40) IDO1NOTUMCYP3A4CYP2D6HTR2A
SCHEMBL3680986 0.76 IDO1 (0.40) IDO1PTPN5CYP3A4CYP2D6HTR2A

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
CN-103958484-B Oxazolidinone derivative, preparation method and medical application thereof SHANGHAI HENGRUI PHARMACEUTICAL CO.,LTD. (CN) 2015-11-25 CN disclosed