SCHEMBL650706

SCHEMBL650706

COc1cccc(/N=C2/NC(=O)/C(=C/c3cnc(N)s3)S2)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.48
KMT2A Q03164 7/20 0.48
MAPT P10636 4/20 0.48
NPSR1 Q6W5P4 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPK1 P28482 1/20 0.47
PTP4A3 O75365 1/20 0.46
GRK6 P43250 1/20 0.44
RNASEL Q05823 1/20 0.42
MAP4K4 O95819 3/20 0.42
PIM1 P11309 3/20 0.42
DYRK1A Q13627 3/20 0.42
PIM3 Q86V86 3/20 0.42
MKNK2 Q9HBH9 3/20 0.42
MAP4K5 Q9Y4K4 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTGS2 P35354 2/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
ALOX15 P16050 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
SCHEMBL650707 1.00 MEN1 (0.48) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL651445 0.91 MEN1 (0.58) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL651446 0.91 MEN1 (0.58) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL649099 0.88 MAPT (0.62) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL649100 0.88 MAPT (0.62) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL649023 0.84 MEN1 (0.46) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL649022 0.84 MEN1 (0.46) MEN1KMT2AMAPTNPSR1L3MBTL1
SCHEMBL652067 0.83 MEN1 (0.46) MEN1KMT2AMAPTL3MBTL1MAPK1
SCHEMBL652068 0.83 MEN1 (0.46) MEN1KMT2AMAPTL3MBTL1MAPK1
SCHEMBL653880 0.81 MAPT (0.48) MEN1KMT2AMAPTNPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2018389-B1 HAFNIUM COMPLEXES OF CARBAZOLYL SUBSTITUTED IMIDAZOLE LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-03-09 EP disclosed
EP-2018390-B1 ORTHO-METALLATED HAFNIUM COMPLEXES OF IMIDAZOLE LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-03-09 EP disclosed
EP-2021381-B1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-12-23 EP disclosed
US-9181368-B2 High activity, low molecular weight olefin polymerization process DOW GLOBAL TECHNOLOGIES LLC (US) 2015-11-10 US disclosed
US-20140066585-A1 HIGH ACTIVITY, LOW MOLECULAR WEIGHT OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES LLC (US) 2014-03-06 US disclosed
US-8604145-B2 High activity, low molecular weight olefin polymerization process DOW GLOBAL TECHNOLOGIES, LLC (US) 2013-12-10 US disclosed
US-8580976-B2 Process for preparing A 2-substituted benzofuran-3-yl borate ester DOW GLOBAL TECHNOLOGIES, LLC (US) 2013-11-12 US disclosed
US-20130102789-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-04-25 US disclosed
US-20130102795-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-04-25 US disclosed
US-20130085284-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-04-04 US disclosed
WO-2000002930-A1 A CATALYST COMPOSITION AND METHODS FOR ITS PREPARATION AND USE IN A POLYMERIZATION PROCESS UNIVATION TECHNOLOGIES LLC (US) 2000-01-20 WO disclosed
EP-0965601-A1 Mixed catalyst composition for the production of olefin polymers UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-12-22 EP disclosed
WO-1999061486-A1 CATALYST DELIVERY METHOD AND CATALYST FEEDER UNIVATION TECHNOLOGIES LLC (US) 1999-12-02 WO disclosed
EP-0952996-A1 METHOD OF CONTROLLING OLEFIN POLYMERIZATION CATALYST COMPOSITION ACTIVITY UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-11-03 EP disclosed
EP-0952995-A1 OLEFIN POLYMERIZATION CATALYST COMPOSITION HAVING INCREASED ACTIVITY UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-11-03 EP disclosed
EP-0942009-A2 Reduced sheeting in single-site and single-site like polymerization by employing a chromium containing compound UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (a Delaware corporation) (US) 1999-09-15 EP disclosed
US-5912202-A CONTACTING OUTSIDE OF POLYMERIZATION REACTOR A SINGLE SITE CATALYST PRECURSOR WITH AN ACTIVATING COCATALYST BEFORE, DURING, OR AFTER CONTACTING THE SINGLE SITE CATALYST PRECURSOR WITH A WEAKLY COORDINATING ELECTRON DONOR SUCH AS 1-HEXENE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-06-15 US disclosed
WO-1998037103-A1 PRODUCTION OF POLYOLEFINS OF CONTROLLED PARTICLE SIZE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-08-27 WO disclosed
WO-1998030608-A1 METHOD OF CONTROLLING OLEFIN POLYMERIZATION CATALYST COMPOSITION ACTIVITY UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-07-16 WO disclosed
WO-1998030606-A1 OLEFIN POLYMERIZATION CATALYST COMPOSITION HAVING INCREASED ACTIVITY UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-07-16 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 (3 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-20130102795-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS HACL2, MIA3, HAO2 MEN1 4102/4885KMT2A 3907/4885MAPT 2920/4885
US-20130085284-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS HACL2, MIA3, HAO2 MEN1 4102/4885KMT2A 3907/4885MAPT 2920/4885
US-20130102789-A1 HAFNIUM COMPLEXES OF HETEROCYCLIC ORGANIC LIGANDS HACL2, MIA3, HAO2 MEN1 4102/4885KMT2A 3907/4885MAPT 2920/4885

“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.