SCHEMBL13708993

SCHEMBL13708993

CCCCCCCCC1(CCCCCC)c2cc(I)ccc2-c2ccc(I)cc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.36
MMP9 P14780 5/20 0.36
MMP8 P22894 4/20 0.36
MMP13 P45452 4/20 0.36
CNR1 P21554 5/20 0.34
CNR2 P34972 5/20 0.34
PDK2 Q15119 2/20 0.33
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 0.31
KMT2A Q03164 1/20 0.31
MMP3 P08254 1/20 0.30
TDP2 O95551 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
SCHEMBL4511675 1.00 MMP2 (0.36) MMP2MMP9MMP8MMP13CNR1
SCHEMBL5849205 1.00 MMP2 (0.36) MMP2MMP9MMP8MMP13CNR1
SCHEMBL1448661 1.00 MMP2 (0.36) MMP2MMP9MMP8MMP13CNR1
SCHEMBL1923234 1.00 MMP2 (0.36) MMP2MMP9MMP8MMP13CNR1
SCHEMBL4634013 0.98 MMP2 (0.33) MMP2MMP9MMP8MMP13CNR1
SCHEMBL1921532 0.93 ELANE (0.33) PDK2MEN1KMT2ATDP2
SCHEMBL12440909 0.92 CNR1 (0.37) MMP2MMP9MMP8MMP13CNR1
SCHEMBL1923373 0.92 PDK2 (0.40) MMP2MMP9MMP8MMP13CNR1
SCHEMBL1921668 0.92 PDK2 (0.40) MMP2MMP9MMP8MMP13CNR1
SCHEMBL16622910 0.92 PDK2 (0.40) MMP2MMP9MMP8MMP13CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558696-B1 NEW METHOD FOR THE PRODUCTION OF MONOMERS USEFUL IN THE MANUFACTURE OF SEMICONDUCTIVE POLYMERS MERCK PATENT GMBH (DE) 2009-09-23 EP disclosed
US-7368616-B2 Method for the production of monomers useful in the manufacture of semiconductive polymers MERCK PATENT GMBH (DE) 2008-05-06 US disclosed
US-7368616-B2 Method for the production of monomers useful in the manufacture of semiconductive polymers MERCK PATENT GMBH (DE) 2008-05-06 US disclosed