SCHEMBL16624945

SCHEMBL16624945

C[C@]1(COc2ccc(-n3cc(-c4ccccn4)nn3)cc2)Cn2cc(I)nc2O1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 0.49
MIF P14174 4/20 0.44
KCNH2 Q12809 4/20 0.41
GRM5 P41594 1/20 0.38
GSK3B P49841 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.34
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
USP1 O94782 1/20 0.33
PTGS2 P35354 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL16624873 0.89 KCNH2 (0.42) FLT3KCNH2PTGS1SLC6A2SLC6A4
SCHEMBL16618228 0.85 KCNH2 (0.61) FLT3MIFKCNH2GRM5GSK3B
SCHEMBL16624950 0.85 KCNH2 (0.42) FLT3KCNH2PTGS1SLC6A2SLC6A4
SCHEMBL16624985 0.82 KCNH2 (0.56) FLT3KCNH2PTGS1SLC6A2SLC6A4
SCHEMBL16624874 0.81 KCNH2 (0.43) KCNH2PTGS1SLC6A2SLC6A4RXRA
SCHEMBL18031081 0.75 KCNH2 (0.63) KCNH2PTGS1SLC6A2SLC6A4PTGS2
SCHEMBL16618217 0.72 KCNH2 (0.61) MIFKCNH2PTGS1SLC6A2SLC6A4
SCHEMBL16618280 0.71 KCNH2 (0.63) FLT3KCNH2PTGS1SLC6A2SLC6A4
SCHEMBL16618251 0.71 KCNH2 (0.62) KCNH2PTGS1SLC6A2SLC6A4PTGS2
SCHEMBL16618223 0.71 KCNH2 (0.63) KCNH2PTGS1SLC6A2SLC6A4

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
WO-2015049693-A1 6-NITRO-2,3-DIHYDROIMIDAZO[2,1-b]OXAZOLES AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-04-09 WO disclosed