SCHEMBL28415035

SCHEMBL28415035

Fc1cccnc1C#CCBr

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
GRM5 P41594 2/20 0.32
OGA O60502 1/20 0.32
FGFR1 P11362 1/20 0.31
FGFR2 P21802 1/20 0.31
FGFR4 P22455 1/20 0.31
FGFR3 P22607 1/20 0.31
KDR P35968 1/20 0.31
NFE2L2 Q16236 3/20 0.31
MPI P34949 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL4327246 0.81 ALDH1A1 (0.37) KDM4EGRM5OGANFE2L2MPI
SCHEMBL18012141 0.81 OGA (0.34) KDM4EGRM5OGAFGFR1FGFR2
SCHEMBL20897967 0.79 ASIC3 (0.37) KDM4EGRM5OGAMPIL3MBTL1
SCHEMBL19602251 0.79 TLR8 (0.35) GRM5OGAFGFR1FGFR2FGFR4
SCHEMBL17035461 0.75 GRM5 (0.34) KDM4EGRM5OGANFE2L2MPI
SCHEMBL22031519 0.75 GRM5 (0.34) KDM4EGRM5OGANFE2L2MPI
SCHEMBL29994316 0.75 GRM5 (0.34) KDM4EGRM5OGANFE2L2MPI
SCHEMBL18827520 0.75 GRM5 (0.34) KDM4EGRM5OGANFE2L2MPI
SCHEMBL22031506 0.74 NAPRT (0.35)
SCHEMBL31098142 0.74 NAPRT (0.35)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111285873-B RET inhibitor, pharmaceutical composition thereof and application thereof 广东东阳光药业股份有限公司 2024-10-15 CN disclosed
CN-111285874-B RET inhibitor, pharmaceutical composition thereof and application thereof 广东东阳光药业股份有限公司 2024-08-09 CN disclosed
CN-111285874-A RET inhibitors, pharmaceutical compositions thereof and uses thereof 广东东阳光药业有限公司 2020-06-16 CN disclosed
CN-111285873-A RET inhibitors, pharmaceutical compositions thereof and uses thereof 广东东阳光药业有限公司 2020-06-16 CN disclosed