SCHEMBL7106532

SCHEMBL7106532

CC(C)C1=CCC([Zr](=C(c2ccccc2)c2ccccc2)c2cccc3c2Cc2ccccc2-3)=C1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PNMT P11086 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
SCHEMBL7934589 0.85 NPC1 (0.37) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL22607471 0.84 NPC1 (0.36) NPC1RAB9APNMT
SCHEMBL7102011 0.83 NPC1 (0.35) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL22607491 0.82 NPC1 (0.34) NPC1RAB9APNMT
SCHEMBL7107707 0.80 PNMT (0.33) NPC1RAB9APNMT
SCHEMBL1081333 0.79 NPC1 (0.39) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL6908139 0.78 NPC1 (0.39) NPC1RAB9APNMT
SCHEMBL7106551 0.77 NPC1 (0.38) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL22607483 0.77 NPC1 (0.31) NPC1RAB9A
Hydrochloric Acid SCHEMBL673941 0.73 NPC1 (0.37) NPC1RAB9APNMT

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-0786466-B1 Olefin polymerisation process which comprises a transition metal catalyst. TOSOH CORP (JP) 2003-04-16 EP disclosed
US-6316558-B1 POLYMERIZING OLEFIN USING CATALYST COMPRISING TRANSITION METAL COMPOUND, COMPOUND CAPABLE OF A REACTING WITH TRANSITION METAL COMPOUND TO FORM A CATIONIC TRANSITION METAL COMPOUND, ORGANOMETALLIC TO FORM POLYOLEFIN TOSOH CORPORATION (JP) 2001-11-13 US disclosed
EP-0786466-A1 Transition metal compound, olefin polymerization catalyst comprising the compound, and process for production of olefin polymer Tosoh Corporation (JP) 1997-07-30 EP disclosed