SCHEMBL22745488

SCHEMBL22745488

CC(C)=C(F)c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
PTPN1 P18031 1/20 0.48
PLK1 P53350 1/20 0.48
MMP3 P08254 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
CDC25B P30305 2/20 0.44
PTK2B Q14289 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 3/20 0.42
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
GMNN O75496 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 2/20 0.42

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
SCHEMBL6437528 0.83 NR4A1 (0.54) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL31749371 0.83 NR4A1 (0.54) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL3255960 0.78 NR4A1 (0.58) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL66680 0.78 NR4A1 (0.58) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL3245130 0.78 NR4A1 (0.58) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL27486785 0.76 NR4A1 (0.61) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL8034961 0.76 NR4A1 (0.56) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL14137890 0.75 NR4A1 (0.50) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL22422804 0.75 NR4A1 (0.50) NR4A1NR4A2NR4A3PTPN1PLK1
SCHEMBL28433272 0.75 NR4A1 (0.50) NR4A1NR4A2NR4A3PTPN1PLK1

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-2020242046-A1 FLUOROALKENE COMPOUND PRECURSOR, METHOD FOR SYNTHESIZING PRECURSOR, AND METHOD FOR PREPARING FLUOROALKENE COMPOUND BY USING PRECURSOR 전남대학교산학협력단 2020-12-03 WO disclosed