SCHEMBL4632268

SCHEMBL4632268

CCCCCC1(CCCCC)c2ccccc2-c2ccc(I)cc21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.39
APEX1 P27695 1/20 0.38
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
MMP8 P22894 2/20 0.35
MMP13 P45452 2/20 0.35
GPR3 P46089 1/20 0.33
PGR P06401 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ELANE P08246 1/20 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
SCHEMBL1921668 0.98 PDK2 (0.40) PDK2APEX1MMP2MMP9MMP8
SCHEMBL1923373 0.98 PDK2 (0.40) PDK2APEX1MMP2MMP9MMP8
SCHEMBL16622910 0.98 PDK2 (0.40) PDK2APEX1MMP2MMP9MMP8
SCHEMBL26226755 0.98 PDK2 (0.40) PDK2APEX1MMP2MMP9MMP8
SCHEMBL664630 0.95 APEX1 (0.39) PDK2APEX1MMP2MMP9MMP8
SCHEMBL4634013 0.92 MMP2 (0.33) PDK2MMP2MMP9MMP8MMP13
SCHEMBL4511675 0.91 MMP2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL1448661 0.91 MMP2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL1923234 0.91 MMP2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL5849205 0.91 MMP2 (0.36) PDK2MMP2MMP9MMP8MMP13

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
EP-1520846-B1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORP (JP) 2008-03-05 EP disclosed
US-7138484-B2 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2006-11-21 US disclosed
US-20050075478-A1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2005-04-07 US disclosed
EP-1520846-A1 Method for producing polymerized hydrocarbon JFE Chemical Corporation (JP) 2005-04-06 EP disclosed