SCHEMBL2998556

SCHEMBL2998556

O=C=NC1=Cc2c(N=C=O)ccc3cccc(c23)C1Cl

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 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
SCHEMBL27168552 0.80 CYP3A4 (0.34) CYP3A4
SCHEMBL28215938 0.80 CYP3A4 (0.34) CYP3A4
SCHEMBL28215582 0.80 CYP3A4 (0.34) CYP3A4
SCHEMBL83099 0.69 CYP3A4 (0.33) CYP3A4
SCHEMBL3809881 0.69
SCHEMBL29193898 0.67 CYP3A4 (0.31) CYP3A4
SCHEMBL7265796 0.67 CYP3A4 (0.31) CYP3A4
SCHEMBL224067 0.63 CYP3A4 (0.60) CYP3A4
SCHEMBL3714083 0.63 ALDH1A1 (0.45) CYP3A4
SCHEMBL3669277 0.63 CYP3A4 (0.50) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018042460-A1 SULPHUR CONTAINING POLYUREA FOR USE IN METAL SCAVENGING, REMOVAL AND RECOVERY AVRA LABORATORIES PVT. LTD. (IN) 2018-03-08 WO claimed
EP-1654055-B1 MICROENCAPSULATED CATALYST-LIGAND SYSTEM, METHODS OF PREPARATION AND METHODS OF USE THEREOF REAXA LTD (GB) 2010-09-22 EP claimed
US-20090221419-A1 Microencapsulated Catalyst-Ligand System REAXA LIMITED (GB) 2009-09-03 US claimed
EP-1993721-A1 MICROENCAPSULATED CATALYST-LIGAND SYSTEM Reaxa Limited (GB) 2008-11-26 EP claimed
WO-2007096592-A1 MICROENCAPSULATED CATALYST-LIGAND SYSTEM REAXA LIMITED (GB) 2007-08-30 WO claimed
US-20070027028-A1 Microencapsulated catalyst-ligand system, methods of preparation and methods of use thereof REAXA LIMITED (GB) 2007-02-01 US claimed
EP-1654055-A1 MICROENCAPSULATED CATALYST-LIGAND SYSTEM, METHODS OF PREPARATION AND METHODS OF USE THEREOF Avecia Pharmaceuticals Limited (GB) 2006-05-10 EP claimed
JP-2005511671-A 2005-04-28 JP claimed
WO-2005016510-A1 MICROENCAPSULATED CATALYST-LIGAND SYSTEM, METHODS OF PREPARATION AND METHODS OF USE THEREOF REAXA LIMITED (GB) 2005-02-24 WO claimed
US-20050010068-A1 Use of microencapsulated transition metal reagents for reactions in supercritical fluids AVECIA LIMITED (GB) 2005-01-13 US claimed
US-20040254066-A1 Dissolving or dispersion forming emulsion; transition metal catalyst encapsulated within a permeable polymer; catalyst for foirming polyol from olefin REAXA LIMITED (GB) 2004-12-16 US claimed
EP-1453780-A1 THE USE OF MICROENCAPSULATED TRANSITION METAL REAGENTS FOR REACTIONS IN SUPERCRITICAL FLUIDS Avecia Limited (GB) 2004-09-08 EP claimed
EP-1409125-A1 MICROENCAPSULATED CATALYST, METHODS OF PREPARATION AND METHODS OF USE THEREOF Avecia Limited (GB) 2004-04-21 EP claimed
WO-2003048090-A1 THE USE OF MICROENCAPSULATED TRANSITION METAL REAGENTS FOR REACTIONS IN SUPERCRITICAL FLUIDS AVECIA LIMITED (GB) 2003-06-12 WO claimed
WO-2003006151-A1 MICROENCAPSULATED CATALYST, METHODS OF PREPARATION AND METHODS OF USE THEREOF AVECIA LIMITED (GB) 2003-01-23 WO claimed
CN-110511345-A A kind of mould proof antistatic aerosil polyurethane composite thermal insulation wallboard BAI ZHONGHUA 2019-11-29 CN disclosed
CN-110382643-A Coating agent composition comprising PVC and plasticizing component 巴斯夫欧洲公司 2019-10-25 CN disclosed
WO-2003048090-A1 THE USE OF MICROENCAPSULATED TRANSITION METAL REAGENTS FOR REACTIONS IN SUPERCRITICAL FLUIDS AVECIA LIMITED (GB) 2003-06-12 WO disclosed
WO-2003006151-A1 MICROENCAPSULATED CATALYST, METHODS OF PREPARATION AND METHODS OF USE THEREOF AVECIA LIMITED (GB) 2003-01-23 WO disclosed
EP-0148769-A1 Process for producing multiple types of microcapsules STAUFFER CHEMICAL COMPANY (US) 1985-07-17 EP 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-20050010068-A1 Use of microencapsulated transition metal reagents for reactions in supercritical fluids HPSE, SIK1, SGK1 CYP3A4 1129/4885

“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.