SCHEMBL6944904

SCHEMBL6944904

OC1CCc2ccc3ccccc3c21

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
HIF1A Q16665 1/20 0.51
ADRA2A P08913 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
NFKB1 P19838 4/20 0.40
NFKB2 Q00653 4/20 0.40
RELA Q04206 4/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
CYP2A6 P11509 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NR3C1 P04150 1/20 0.39
ACHE P22303 1/20 0.39
KCNH2 Q12809 1/20 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
SCHEMBL6986089 0.81 HSD17B10 (0.42) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL21474925 0.79 CYP1A2 (0.39) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL585157 0.77 CYP11B1 (0.35) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL28166677 0.75 HPRT1 (0.44) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL28166678 0.75 HPRT1 (0.44) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL13344952 0.74 CYP1A2 (0.45) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL6775661 0.73 CYP1A2 (0.67) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL20569762 0.71 ADRA2A (0.51) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL8361830 0.70 ALDH1A1 (0.48) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A
SCHEMBL23515473 0.70 CYP1A2 (0.45) CYP1A2CYP2C9CYP2D6CYP2C19HIF1A

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
EP-1157047-B1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORP NORTH AMERICA INC (US) 2003-04-23 EP disclosed
US-6479424-B1 FOR PRODUCING OLEFIN POLYMERS AND ESPECIALLY ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. 2002-11-12 US disclosed
EP-1157047-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP Corporation North America Inc. (US) 2001-11-28 EP disclosed
WO-2000035975-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. (US) 2000-06-22 WO disclosed
US-5942459-A ALUMOXANE-FREE MIXTURE OF TRANSITION METAL METALLOCENE, ORGANOALUMINUM COMPOUND, BORIC ACID-CONTAINING POWDER MITSUBISHI CHEMICAL CORPORATION (JP) 1999-08-24 US disclosed
US-5861522-A Production of bridged metallocene complexes and intermediates therefor ALBEMARLE CORPORATION (US) 1999-01-19 US disclosed
US-5861522-A Production of bridged metallocene complexes and intermediates therefor ALBEMARLE CORPORATION (US) 1999-01-19 US disclosed
EP-0728773-B1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEM CORP (JP) 1998-11-04 EP disclosed
EP-0854876-A2 PRODUCTION OF BRIDGED METALLOCENE COMPLEXES AND INTERMEDIATES THEREFOR ALBEMARLE CORPORATION (US) 1998-07-29 EP disclosed
EP-0854876-A2 PRODUCTION OF BRIDGED METALLOCENE COMPLEXES AND INTERMEDIATES THEREFOR ALBEMARLE CORPORATION (US) 1998-07-29 EP disclosed
WO-1997049712-A3 PRODUCTION OF BRIDGED METALLOCENE COMPLEXES AND INTERMEDIATES THEREFOR ALBEMARLE CORP (US) 1998-02-26 WO disclosed
EP-0692505-B1 Process for procucing propylene block copolymers MITSUBISHI CHEM CORP (JP) 1998-01-28 EP disclosed
US-5710299-A Production of bridged metallocene complexes and intermediates therefor ALBEMARLE CORPORATION (US) 1998-01-20 US disclosed
US-5710299-A Production of bridged metallocene complexes and intermediates therefor ALBEMARLE CORPORATION (US) 1998-01-20 US disclosed
WO-1997049712-A2 PRODUCTION OF BRIDGED METALLOCENE COMPLEXES AND INTERMEDIATES THEREFOR ALBEMARLE CORPORATION (US) 1997-12-31 WO disclosed
WO-1997049712-A2 PRODUCTION OF BRIDGED METALLOCENE COMPLEXES AND INTERMEDIATES THEREFOR ALBEMARLE CORPORATION (US) 1997-12-31 WO disclosed
US-5623022-A VAPOR PHASE; USING COORDINATION CATALYST MITSUBISHI CHEMICAL CORPORATION (JP) 1997-04-22 US disclosed
EP-0728773-A1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-28 EP disclosed
EP-0692505-A2 Process for procucing propylene block copolymers MITSUBISHI CHEMICAL CORPORATION (JP) 1996-01-17 EP disclosed