SCHEMBL4318924

SCHEMBL4318924

COC(=O)c1ccccc1Oc1nc(Oc2ccccc2C(=O)OC)nc(Oc2ccccc2C(=O)OC)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
KMT2A Q03164 4/20 0.66
MEN1 O00255 2/20 0.66
SLC6A3 Q01959 2/20 0.56
NPSR1 Q6W5P4 2/20 0.55
CYP1A2 P05177 3/20 0.53
CYP2C9 P11712 3/20 0.53
CYP2C19 P33261 3/20 0.53
CYP3A4 P08684 2/20 0.53
ATM Q13315 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 2/20 0.51
HSD17B10 Q99714 2/20 0.50
CFTR P13569 1/20 0.50
SLC6A4 P31645 1/20 0.50
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL9384288 0.95 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL9380930 0.88 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL4306813 0.88 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL2976362 0.88 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1
SCHEMBL9382720 0.87 KMT2A (0.75) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL2441955 0.87 SLC6A3 (0.65) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL9380390 0.86 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL9384430 0.86 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL4310256 0.86 SMN1; SMN2 (0.58) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3
SCHEMBL4312718 0.85 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2KMT2AMEN1SLC6A3

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