SCHEMBL2529413

SCHEMBL2529413

CC1=Cc2c(C(C)C)cccc2C1[Zr](Cl)(Cl)C1C(C)=Cc2c(C(C)C)cccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
FAAH O00519 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
GABRB1 P18505 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
HTR2B P41595 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 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
SCHEMBL8633284 0.88 CA12 (0.33) CA1CA2TSHR
SCHEMBL7632473 0.86 LMNA (0.31) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL27492988 0.85 GABRA1 (0.34) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL7126938 0.85 LMNA (0.30) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL7640461 0.84 GABRA1 (0.33) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL7641589 0.84 GABRA1 (0.33) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL27473872 0.81 FAAH (0.32) LMNAGABRA1GABRG2GABRB3FAAH
Hydrochloric Acid SCHEMBL7632478 0.81 FAAH (0.32) LMNAGABRA1GABRG2GABRB3FAAH
Ethane SCHEMBL8633257 0.80 FAAH (0.31) LMNAGABRA1GABRG2GABRB3FAAH
SCHEMBL8636162 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2033975-B1 Catalyst composition BASELL POLYOLEFINE GMBH (DE) 2014-05-14 EP disclosed
US-8039569-B2 Polyethylene molding compositions for injection molding applications BASELL POLYOLEFINE GMBH (DE) 2011-10-18 US disclosed
EP-1874830-B1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST BASELL POLYOLEFINE GMBH (DE) 2010-10-20 EP disclosed
US-20090311453-A1 Molding compostion comprsing polyethlene for preparing films and process for preparing the molding composition in the presence of a mixed catalyst BASELL POLYOLEFINE GMBH (DE) 2009-12-17 US disclosed
US-20090306324-A1 Polyethylene molding compositions for injection molding applications BASELL POLYOLEFINE GMBH (DE) 2009-12-10 US disclosed
EP-2033975-A1 Catalyst composition Basell Polyolefine GmbH (DE) 2009-03-11 EP disclosed
EP-1874831-B1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS BASELL POLYOLEFINE GMBH (DE) 2008-12-03 EP disclosed
EP-1874831-A1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS Basell Polyolefine GmbH (DE) 2008-01-09 EP disclosed
EP-1874830-A1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST Basell Polyolefine GmbH (DE) 2008-01-09 EP disclosed
WO-2006114209-A1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST BASELL POLYOLEFINE GMBH (DE) 2006-11-02 WO disclosed
WO-2006114210-A1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS BASELL POLYOLEFINE GMBH (DE) 2006-11-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090311453-A1 Molding compostion comprsing polyethlene for preparing films and process for preparing the molding composition in the presence of a mixed catalyst MAFG, PARG, MICOS13 LMNA 1337/4885GABRA1 2980/4885GABRG2 960/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.