SCHEMBL7733856

SCHEMBL7733856

C1=CCC([Zr](=C2CCCCC2)c2c(-c3ccccc3)ccc3c2Cc2cc(-c4ccccc4)ccc2-3)=C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.33
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
PARP10 Q53GL7 1/20 0.30
PARP11 Q9NR21 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
SCHEMBL7735613 1.00 TDP2 (0.33) TDP2MMP12MMP13PARP10PARP11
SCHEMBL7733087 0.99 TDP2 (0.34) TDP2MMP12MMP13PARP10PARP11
SCHEMBL7735605 0.97 TDP2 (0.34) TDP2PARP10PARP11
SCHEMBL6227856 0.80
Hydrochloric Acid SCHEMBL16594222 0.78 TDP2 (0.34) TDP2
SCHEMBL4957193 0.75
SCHEMBL21407044 0.75
SCHEMBL7735611 0.74
SCHEMBL7724773 0.74
SCHEMBL2805279 0.74

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
US-6342568-B1 ADDITION POLYMERIZATION OF HIGHLYS STEREOSPECIFIC AND LOW MOLECULAR WEIGHT POLYOLEFINS USING CATALYST COMPRISING CYCLOPENTADIENYL-SUBSTITUTED FLUORENE COMPOUND COMPLEXED WITH GROUP IV METAL MITSUI CHEMICALS, INC. (JP) 2002-01-29 US disclosed
EP-0955305-A1 Metallocene compound, and process for preparing polyolefin by using it Mitsui Chemicals, Inc. (JP) 1999-11-10 EP disclosed