SCHEMBL4319042

SCHEMBL4319042

CCCCOc1nc(Cl)nc(Oc2c(C)cc(C)cc2C)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
CRHR1 P34998 4/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TLR7 Q9NYK1 2/20 0.32

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
SCHEMBL49631 0.87 HSP90AA1 (0.46) HSP90AA1CRHR1KMT2AKDM4EALDH1A1
SCHEMBL9188392 0.87 HSP90AA1 (0.44) HSP90AA1CRHR1MEN1KMT2A
SCHEMBL49241 0.86 HSP90AA1 (0.41) HSP90AA1CRHR1KMT2AKDM4EALDH1A1
SCHEMBL49211 0.84 HSP90AA1 (0.53) HSP90AA1CRHR1MEN1KMT2AKDM4E
SCHEMBL4307871 0.81 HSP90AA1 (0.53) HSP90AA1CRHR1MEN1KMT2AKDM4E
SCHEMBL6051629 0.81 RAB9A (0.41) KDM4ETLR7
SCHEMBL1318906 0.78 RAB9A (0.41) KDM4EALDH1A1TLR7
SCHEMBL259402 0.77 HSP90AA1 (0.39) HSP90AA1MEN1KMT2AALDH1A1
SCHEMBL17486055 0.74 NR5A1 (0.40) KMT2AALDH1A1
SCHEMBL11395631 0.74 NR5A1 (0.40) KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423372-B1 TRIAZINE COMPOUNDS, POLYMERS COMPRISING TRIAZINE STRUCTURAL UNITS, AND PROCESSES FOR THE PREPARATION OF THESE POLYMERS SABIC GLOBAL TECHNOLOGIES BV (NL) 2016-07-20 EP disclosed
US-7547749-B2 Triazine compounds, polymers comprising triazine structural units, and method SABIC INNOVATIVE PLATICS IP B.V. (NL) 2009-06-16 US disclosed
US-20080097040-A1 TRIAZINE COMPOUNDS, POLYMERS COMPRISING TRIAZINE STRUCTURAL UNITS, AND METHOD GENERAL ELECTRIC COMPANY (US) 2008-04-24 US disclosed
US-7235611-B2 Triazine compounds, polymers comprising triazine structural units, and method GENERAL ELECTRIC COMPANY (US) 2007-06-26 US disclosed
US-20050192411-A1 Triazine compounds, polymers comprising triazine structural units, and method GENERAL ELECTRIC CO. 2005-09-01 US disclosed
EP-1423372-A2 TRIAZINE COMPOUNDS, POLYMERS COMPRISING TRIAZINE STRUCTURAL UNITS, AND PROCESSES FOR THE PREPARATION OF THESE POLYMERS GENERAL ELECTRIC COMPANY (US) 2004-06-02 EP disclosed
US-20030078347-A1 Triazine compounds, polymers comprising triazine structural units, and method GENERAL ELECTRIC COMPANY 2003-04-24 US disclosed
WO-2003024939-A2 TRIAZINE COMPOUNDS POLYMERS COMPRISING TRIAZINE STRUCTURAL UNITS, AND PROCESSES FOR THE PREPARATION OF THESE POLYMERS GENERAL ELECTRIC COMPANY (US) 2003-03-27 WO disclosed