SCHEMBL29449999

SCHEMBL29449999

Fc1ccc(NCc2ccc(Cl)nc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
GAA P10253 2/20 0.58
MAPT P10636 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
AURKA O14965 1/20 0.57
ABL1 P00519 1/20 0.57
NTRK1 P04629 1/20 0.57
LCK P06239 1/20 0.57
CSF1R P07333 1/20 0.57
RET P07949 1/20 0.57
MET P08581 1/20 0.57
PDGFRB P09619 1/20 0.57
PIM1 P11309 1/20 0.57
PDGFRA P16234 1/20 0.57
FLT3 P36888 1/20 0.57
MAPK8 P45983 1/20 0.57
CDK8 P49336 1/20 0.57
MAP2K1 Q02750 1/20 0.57
MAP4K2 Q12851 1/20 0.57
ROCK1 Q13464 1/20 0.57

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
SCHEMBL3056256 1.00 KDM4E (0.58) KDM4EGAAMAPTL3MBTL1AURKA
SCHEMBL28707400 0.85 KDM4E (0.57) KDM4EGAAMAPTL3MBTL1AURKA
SCHEMBL933730 0.84 KDM4E (0.47) KDM4EGAAMAPTL3MBTL1AURKA
SCHEMBL30862011 0.83 KDM4E (0.72) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL28892513 0.83 KDM4E (0.53) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL13090580 0.83 KDM4E (0.72) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL28701830 0.83 MAPT (0.58) KDM4EGAAMAPTL3MBTL1AURKA
SCHEMBL28707397 0.81 MAPT (0.56) KDM4EGAAMAPTL3MBTL1NTRK1
SCHEMBL28711242 0.81 KDM4E (0.55) KDM4EGAAMAPTL3MBTL1AURKA
SCHEMBL4740818 0.80 AURKA (0.65) KDM4EGAAAURKAABL1NTRK1

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
CN-114075177-B 4-Aminofuran-2 (5H) -ketone derivative and preparation method and application thereof 东莞市东阳光农药研发有限公司 2024-11-29 CN disclosed
CN-114075177-A 4-amino furan-2 (5H) -ketone derivative and preparation method and application thereof 东莞市东阳光农药研发有限公司 2022-02-22 CN disclosed