SCHEMBL4398016

SCHEMBL4398016

CC(C)c1cccc(C(C)C)c1N=N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRB2 P47870 2/20 0.48
LMNA P02545 2/20 0.48
FAAH O00519 2/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
GABRB1 P18505 1/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
HTR2C P28335 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
HTR2B P41595 1/20 0.48
GABRA2 P47869 1/20 0.48

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
SCHEMBL24022546 0.79 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL4948085 0.76 GABRA1 (0.44) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL14101410 0.76 GABRA1 (0.44) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL365437 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL16919083 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL8755372 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL185135 0.75 GABRA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
Hydrochloric Acid SCHEMBL7761669 0.73 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL19336659 0.73 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL7685142 0.73 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA

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-2227479-B1 CYCLOPENTADIENYLPHOSPHAZENE COMPLEXES (CpPN COMPLEXES) OF METALS OF THE THIRD AND FOURTH GROUP AND OF THE LANTHANOIDS UNIV MARBURG PHILIPPS (DE) 2012-05-02 EP disclosed
US-20110034715-A1 Cyclopentadienylphosphazene complexes (CpPN Complexes) of metals of the third and fourth group and of the lanthanoids PHILIPPS-UNIVERSITAT MARBURG (DE) 2011-02-10 US disclosed
WO-2009068000-A2 CYCLOPENTADIENYLPHOSPHAZENE COMPLEXES (CpPN COMPLEXES) OF METALS OF THE THIRD AND FOURTH GROUP AND OF THE LANTHANOIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2009-06-04 WO disclosed
US-7199255-B2 Imino-amide catalysts for olefin polymerization UNIVATION TECHNOLOGIES, LLC (US) 2007-04-03 US disclosed
US-20050187362-A1 Novel imino-amide catalysts for olefin polymerization UNIVATION TECHNOLOGIES, LLC 2005-08-25 US disclosed
US-6919413-B2 Imino-amide catalyst compositions for the polymerization of olefins UNIVATION TECHNOLOGIES, LLC (US) 2005-07-19 US disclosed
US-6919467-B2 Imino-amide catalyst compositions for the polymerization of olefins UNIVATION TECHNOLOGIES, LLC (US) 2005-07-19 US disclosed
EP-1456252-A1 IMINO-AMIDE CATALYST COMPOSITIONS FOR THE POLYMERIZATION OF OLEFINS Univation Technologies LLC (US) 2004-09-15 EP disclosed
US-20030191012-A1 Imino-amide catalyst compositions for the polymerization of olefins MURRAY REX EUGENE (US) 2003-10-09 US disclosed
US-20030171206-A1 Imino-amide catalyst compositions for the polymerization of olefins UNIVATION TECHNOLOGIES, LLC 2003-09-11 US disclosed
WO-2003051935-A1 IMINO-AMIDE CATALYST COMPOSITIONS FOR THE POLYMERIZATION OF OLEFINS UNIVATION TECHNOLOGIES, LLC (US) 2003-06-26 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 (2 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-20050187362-A1 Novel imino-amide catalysts for olefin polymerization PAM, POF1B, TPR GABRA1 4043/4885GABRG2 4365/4885GABRB3 4398/4885
US-20110034715-A1 Cyclopentadienylphosphazene complexes (CpPN Complexes) of metals of the third and fourth group and of the lanthanoids CPNE4, CPN1, NCLN GABRA1 2884/4885GABRG2 1871/4885GABRB3 1265/4885

“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.