SCHEMBL6685548

SCHEMBL6685548

CC(C)(C)C1=CCC2=C1CCC1=C(CC=C1C(C)(C)C)c1cc(C(F)(F)F)ccc1O[Zr]Oc1ccc(C(F)(F)F)cc12

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.30
PARP10 Q53GL7 1/20 0.30
KIF11 P52732 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
SCHEMBL8082804 0.63
SCHEMBL5084192 0.60
SCHEMBL8083664 0.59 CYP1A2 (0.38)
SCHEMBL30574501 0.56 MAOB (0.46) PARP1PARP10
SCHEMBL86946 0.56 MAOB (0.46) PARP1PARP10
SCHEMBL13538433 0.56 PIK3CA (0.40) PARP1PARP10
SCHEMBL69688 0.55 TERT (0.46) PARP1PARP10KIF11
SCHEMBL21384283 0.55 TDP2 (0.38) PARP1PARP10KIF11
SCHEMBL30201259 0.54 PARP1 (0.62) PARP1PARP10KIF11
SCHEMBL3680946 0.54 PARP1 (0.62) PARP1PARP10KIF11

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
EP-1380598-A1 Supported catalyst for olefin polymerization and process for polymerizing olefin by means thereof MARUZEN PETROCHEMICAL CO., LTD. (JP) 2004-01-14 EP disclosed