SCHEMBL28061512

SCHEMBL28061512

[CH2]Cc1cc(C)c(OCCOC)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 4/20 0.32
L3MBTL1 Q9Y468 3/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTR2A P28223 2/20 0.31
HTR7 P34969 2/20 0.31

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
SCHEMBL28061526 0.91 S1PR2 (0.36) S1PR2S1PR1S1PR3LPAR2KMT2A
SCHEMBL15220339 0.78 MAPT (0.38) S1PR2S1PR1S1PR3LPAR2KMT2A
SCHEMBL8417929 0.76 KMT2A (0.49) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10348382 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10348410 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10348443 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10348444 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10348383 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL10349008 0.74 MAPT (0.51) KMT2AMEN1MAPTL3MBTL1LMNA
SCHEMBL27986524 0.74 S1PR2 (0.36) S1PR2S1PR1S1PR3LPAR2KMT2A

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-105906617-A Modulators of HEC1 activity and methods thereof 泰纬生命科技股份有限公司 2016-08-31 CN disclosed
CN-103038231-B Modulators of HEC1 activity and methods thereof Taivex Therapeutics Corp. (CN) 2016-04-20 CN disclosed