SCHEMBL27418690

SCHEMBL27418690

CC(C[AlH2])c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.58
AOC3 Q16853 2/20 0.52
TRPA1 O75762 4/20 0.50
RIPK1 Q13546 1/20 0.50
MIF P14174 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL28507629 1.00 TAAR1 (0.58) TAAR1AOC3TRPA1RIPK1MIF
SCHEMBL3672929 0.78 TRPA1 (0.67) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL6280516 0.78 RIPK1 (0.67) TAAR1AOC3TRPA1RIPK1
SCHEMBL2931566 0.77 ADRB2 (0.52) AOC3HTR2AHRH1LMNA
SCHEMBL2925065 0.77 HDAC4 (0.42) TAAR1KDM4EALDH1A1LMNA
SCHEMBL4443642 0.76 TAAR1 (0.61) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL136376 0.76 TAAR1 (0.61) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL17453236 0.76 TAAR1 (0.61) TAAR1AOC3TRPA1RIPK1ALDH1A1
Benzene SCHEMBL5290987 0.76 TAAR1 (0.61) TAAR1AOC3TRPA1RIPK1ALDH1A1
Lithium SCHEMBL30777534 0.76 RIPK1 (0.64) TAAR1AOC3TRPA1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1113899-C Catalysts and processes for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 2003-07-09 CN claimed
CN-1135761-A Catalysts and processes for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 1996-11-13 CN claimed
CN-106795181-B The pyridine complex of zirconium, the catalyst system of pyridine complex comprising the zirconium and the technique that makes conjugated diene (co) polymerization 维尔萨利斯股份公司 2019-10-08 CN disclosed
CN-110167949-A The technique that oxo nitrogenizes iron complex, the catalyst system including oxo nitridation iron complex and the (co) polymerization for conjugated diene 维尔萨利斯股份公司 2019-08-23 CN disclosed
CN-105683231-B From stereoregulated polymerization with 1,4- it is cis-/the stereoregular diblock polybutadiene of 1,2 structure of syndiotaxy 维尔萨利斯股份公司 2019-06-07 CN disclosed
CN-105683230-B From stereoregulated polymerization with 1,4- it is cis-/the stereoregular diblock polybutadiene of 1,2 structure of syndiotaxy 维尔萨利斯股份公司 2018-07-13 CN disclosed
CN-108137744-A The method that the (co) polymer of conjugated diene is prepared in the presence of the catalyst system and catalyzing comprising vanadium diimine complex compound 维尔萨利斯股份公司 2018-06-08 CN disclosed
CN-101291986-B Polypropylene for injection molding BASELL POLYOLEFINE GMBH (DE) 2011-12-14 CN disclosed
CN-101115796-B Process for producing thermoformed articles BASELL POLYOLEFINE GMBH 2010-11-17 CN disclosed
CN-101044172-B 1-butene polymer and process for the preparation thereof BASELL POLYOLEFINE GMBH 2010-09-29 CN disclosed
CN-101291986-A Polypropylene for injection molding BASELL POLYOLEFINE GMBH (DE) 2008-10-22 CN disclosed
CN-101115796-A Process for producing thermoformed articles BASELL POLYOLEFINE GMBH (DE) 2008-01-30 CN disclosed
CN-101044172-A 1-butene polymer and process for the preparation thereof BASELL POLYOLEFINE GMBH (DE) 2007-09-26 CN disclosed
CN-101023105-A Metallocene compounds, ligands used in their preparation, preparation of 1-butene polymers and 1-butene polymers obtained therefrom BASELL POLYOLEFINE GMBH (DE) 2007-08-22 CN disclosed
CN-1849350-A multi-step process for preparing heterophasic propylene copolymers BASELL POLYOLEFINE GMBH (DE) 2006-10-18 CN disclosed
CN-1113899-C Catalysts and processes for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 2003-07-09 CN disclosed
CN-1286703-A Catalyst components for polymerization of dienes, catalyst obtained therefrom, and process for preparation of polydienes using same MONTELL TECHNOLOGY COMPANY BV (NL) 2001-03-07 CN disclosed
CN-1226894-A Metallocene and olefin polymerization catalyst MONTELL TECHNOLOGY COMPANY BV (NL) 1999-08-25 CN disclosed
CN-1135761-A Catalysts and processes for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 1996-11-13 CN disclosed