SCHEMBL7629830

SCHEMBL7629830

CC1=C(C)C(C)C([Ti](C2=C(C)C(C)=C(C)C2C)[SiH](C)C)=C1C.c1ccc(CCc2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.35
MAOA P21397 2/20 0.35
FFAR1 O14842 1/20 0.33
P2RX7 Q99572 1/20 0.32
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
ACHE P22303 1/20 0.31
TAAR1 Q96RJ0 2/20 0.31
ATM Q13315 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
CASP1 P29466 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL7031405 0.81 MAOB (0.37) MAOBMAOAFFAR1KCNH2SIGMAR1
SCHEMBL27565879 0.78
SCHEMBL7193826 0.70 MAOA (0.39) MAOBMAOAFFAR1KCNH2SIGMAR1
SCHEMBL4564491 0.70 LMNA (0.34) ACHE
Hydrochloric Acid SCHEMBL7639447 0.69 LMNA (0.33)
SCHEMBL9064177 0.67 TP53 (0.34) MAOBMAOASIGMAR1ACHEALDH1A1
SCHEMBL12506236 0.64 MAOB (0.72) MAOBMAOAFFAR1KCNH2SIGMAR1
SCHEMBL55138 0.64 MAOB (0.72) MAOBMAOAFFAR1KCNH2SIGMAR1
SCHEMBL9244022 0.64 CALM1 (0.42) TAAR1ATM
SCHEMBL3690826 0.64 CALM1 (0.42) TAAR1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742233-B1 METHOD OF CONTROLLING MOLECULAR WEIGHT OF STYRENIC POLYMER IDEMITSU KOSAN CO (JP) 2002-02-27 EP disclosed
EP-0769504-B1 PROCESS FOR PRODUCING STYRENIC POLYMER IDEMITSU KOSAN CO (JP) 1999-11-24 EP 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-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