SCHEMBL2232977

SCHEMBL2232977

CC1=C(c2cccc3ccccc23)c2ccccc2C1[Zr](C1C(C)=C(c2cccc3ccccc23)c2ccccc21)[SiH](C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
TDP2 O95551 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP3 P42574 1/20 0.35
HTT P42858 1/20 0.35
GALK1 P51570 1/20 0.35
BLM P54132 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
CYP2A6 P11509 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
Hydrochloric Acid SCHEMBL2236336 0.99 ALDH1A1 (0.34) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL3672744 0.85 MAPT (0.36) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL8679845 0.84 ALDH1A1 (0.36) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL8678777 0.80 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTHPGDL3MBTL1
Hydrochloric Acid SCHEMBL7638183 0.79 KDM1A (0.33) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL3676185 0.75 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL8202195 0.75 GPR3 (0.31)
SCHEMBL2233262 0.74 DHFR (0.35) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL7252933 0.74 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTHPGDL3MBTL1
SCHEMBL7996886 0.74 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799726-B1 TRIALKYLALUMINUM TREATED SUPPORTS EXXONMOBIL CHEM PATENTS INC (US) 2011-07-13 EP claimed
US-7807769-B2 Isotactic polypropylene produced from supercritical polymerization process EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-10-05 US claimed
EP-2231726-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS ExxonMobil Chemical Patents Inc. (US) 2010-09-29 EP claimed
WO-2009123663-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-08 WO claimed
US-20080214767-A1 Isotactic Polypropylene Produced From Supercritical Polymerization Process EXXONMOBIL CHEMICAL PATENTS INC. 2008-09-04 US claimed
US-7807769-B2 Isotactic polypropylene produced from supercritical polymerization process EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-10-05 US disclosed
EP-2231726-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS ExxonMobil Chemical Patents Inc. (US) 2010-09-29 EP disclosed
WO-2009123663-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-08 WO disclosed
US-20080214767-A1 Isotactic Polypropylene Produced From Supercritical Polymerization Process EXXONMOBIL CHEMICAL PATENTS INC. 2008-09-04 US disclosed
WO-2002036643-A1 METHOD FOR POLYMERISING ALPHA-OLEFINS SOLVAY POLYOLEFINS EUROPE - BELGIUM (Société Anonyme) (BE) 2002-05-10 WO disclosed
EP-1201683-A1 Process for the polymerisation of alpha-olefins SOLVAY POLYOLEFINS EUROPE - BELGIUM (Société Anonyme) (BE) 2002-05-02 EP disclosed
US-6177527-B1 PRECATALYST COMPRISING A MIXTURE OF RACEMIC AND MESO STEREOISOMERS OF A METALLOCENE CATALYST; COCATALYST SELECTED FROM THE GROUP CONSISTING OF TRIS(PERFLUOROPHENYL)BORANE AND ISOBUTYL ALUMOXANE UNION CARBIDE CHEMICAL & PLASTICS TECHNOLOGY CORPORATION 2001-01-23 US disclosed
EP-0992517-A2 A process for the preparation of polyethylene or polypropylene UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-04-12 EP disclosed