SCHEMBL628859

SCHEMBL628859

C(/C=C/Cc1ccccc1)=C\Cc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.78
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
ARG2 P78540 1/20 0.56
TOP1 P11387 1/20 0.45
CALM1 P0DP23 1/20 0.45
IDO1 P14902 2/20 0.42
MAPK1 P28482 1/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LOXL2 Q9Y4K0 2/20 0.41
TP53 P04637 1/20 0.41
TRPA1 O75762 1/20 0.41
AGXT P21549 1/20 0.40
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
CASP1 P29466 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KCNH2 Q12809 2/20 0.39

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
SCHEMBL462351 1.00 MAOB (0.78) MAOBCA1CA2ARG2TOP1
SCHEMBL30075910 0.97 MAOB (0.74) MAOBCA1CA2ARG2TOP1
SCHEMBL27558493 0.97 MAOB (0.74) MAOBCA1CA2ARG2TOP1
SCHEMBL15466750 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL6662237 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL15466749 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL9110389 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL95697 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL9110392 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL11599869 0.88 MAOB (0.61) MAOBCA1CA2ARG2TOP1

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 604 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2721043-B1 METAL COMPLEXES COMPRISING AZABENZIMIDAZOLE CARBENE LIGANDS AND THE USE THEREOF IN OLEDS UDC IRELAND LTD (IE) 2018-08-29 EP claimed
EP-2694560-B1 TITANIUM-CATALYST SYSTEM COMPRISING SUBSTITUTED CYCLOPENTADIENYL, GUANIDINE AND DIENE LIGANDS Arlanxeo Netherlands Bv (NL) 2016-08-24 EP claimed
US-9315594-B2 Titanium-catalyst system comprising substituted cyclopentadienyl, guanidine and diene ligands LANXESS ELASTOMERS B.V. (NL) 2016-04-19 US claimed
CN-1681858-A Supercritical polymerization process and polymers produced therefrom EXXONMOBIL CHEM PATENTS INC (US) 2005-10-12 CN claimed
EP-1567566-A1 HIGH TEMPERATURE BULK POLYMERIZATION OF BRANCHED CRYSTALLINE POLYPROPYLENE Exxonmobil Chemical Patents Inc. (US) 2005-08-31 EP claimed
CN-1210280-C Integrated process for preparation of diene complexes DOW WORLDWIDE TECHNOLOGIES CO (US) 2005-07-13 CN claimed
EP-1443062-A2 Homopolymers and copolymers of ethylene BP Chemicals Limited (GB) 2004-08-04 EP claimed
US-20040132935-A1 Branched crystalline polypropylene EXXONMOBIL CHEMICAL PATENTS INC. 2004-07-08 US claimed
WO-2004052950-A1 HIGH TEMPERATURE BULK POLYMERIZATION OF BRANCHED CRYSTALLINE POLYPROPYLENE EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-06-24 WO claimed
US-20040122191-A1 Supercritical polymerization process and polymers produced therefrom EXXONMOBIL CHEMICAL PATENTS INC 2004-06-24 US claimed
EP-0767804-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1997-04-16 EP claimed
EP-0705269-B1 TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM DOW CHEMICAL CO (US) 1997-01-15 EP claimed
WO-1996034001-A1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-10-31 WO claimed
US-5543480-A USING GROUP 4 METAL COMPLEXES CONTAINING A DIENE MOIETY THE DOW CHEMICAL COMPANY (US) 1996-08-06 US claimed
WO-1996017857-A1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-06-13 WO claimed
US-5512693-A Preparation of titanium (II) or zirconium (II) complexes THE DOW CHEMICAL COMPANY (US) 1996-04-30 US claimed
US-5491246-A Synthesis of group 4 metal diene complexes THE DOW CHEMICAL COMPANY (US) 1996-02-13 US claimed
WO-1996000742-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1996-01-11 WO claimed
US-5470993-A Titanium(II) or zirconium(II) complexes and addition polymerization catalysts therefrom THE DOW CHEMICAL COMPANY (US) 1995-11-28 US claimed
US-4480133-A Chemical process ETHYL CORPORATION (US) 1984-10-30 US claimed