SCHEMBL7029454

SCHEMBL7029454

C=[Ti](c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2.c1ccc(CCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.44
RAB9A P51151 2/20 0.38
APAF1 O14727 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
CASP1 P29466 1/20 0.38
BLM P54132 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.36
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
HTR7 P34969 1/20 0.34
HTR2B P41595 1/20 0.34
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL7035302 0.85 PNMT (0.35) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7028960 0.82 PNMT (0.42) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7025953 0.81 PNMT (0.44) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7631934 0.81 PNMT (0.41) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL27755193 0.78 PNMT (0.62) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7027338 0.77 PNMT (0.33) PNMTRAB9AAPAF1ALDH1A1MAPT
Fluorene SCHEMBL22720649 0.76 ALDH1A1 (0.51) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7033609 0.75 PNMT (0.46) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7028986 0.73 PNMT (0.35) PNMTRAB9AAPAF1ALDH1A1MAPT
SCHEMBL7634976 0.73 PNMT (0.34) PNMTRAB9AAPAF1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811628-B1 METHYLALUMINO-OXY COMPOUNDS AND CATALYSTS FOR THE PREPARATION O POLYMERS CONTAINING THE SAME IDEMITSU PETROCHEMICAL CO (JP) 2003-03-05 EP disclosed
EP-0742233-B1 METHOD OF CONTROLLING MOLECULAR WEIGHT OF STYRENIC POLYMER IDEMITSU KOSAN CO (JP) 2002-02-27 EP disclosed
US-6277934-B1 A SYNDIOTACTIC HOMO- OR COPOLYMER FROM A STYRENIC COMPOUND IN THE PRESENCE OF A METALLOCENE OF HIGH, STABLE ACTIVITY COMPRISING A TITANIUM COMPOUND AND AN ORGANIC ALUMINOXY COMPOUND OF SPECIFIC NUCLEAR MAGNETIC RESONANCE SPECTRUM IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6034191-A Organic aluminoxy compound and catalyst for producing polymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-03-07 US disclosed
EP-0769504-B1 PROCESS FOR PRODUCING STYRENIC POLYMER IDEMITSU KOSAN CO (JP) 1999-11-24 EP disclosed
US-5917073-A Organic aluminoxy compound and catalyst for producing polymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1999-06-29 US disclosed
US-5824753-A MULTISTAGE POLYMERIZATION TO PRODUCE SYNDIOTACTIC CONFIGURATION, HYDROGEN INTRODUCED IN ONE STAGE IDEMITSU KOSAN CO., LTD. (JP) 1998-10-20 US disclosed
US-5739227-A USING CATALYSTS COMPRISING TRANSITION METAL COMPOUND, ALUMOXANE OR COORDINATED COMPLEX, ALKYLATING AGENT, AND ORGANOMETALLIC COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 1998-04-14 US disclosed
EP-0811628-A1 ORGANIC ALUMINO-OXY COMPOUNDS AND CATALYSTS FOR THE PREPARATION O POLYMERS CONTAINING THE SAME IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1997-12-10 EP disclosed
EP-0769504-A1 PROCESS FOR PRODUCING STYRENIC POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-04-23 EP disclosed
EP-0742233-A1 METHOD OF CONTROLLING MOLECULAR WEIGHT OF STYRENIC POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1996-11-13 EP disclosed