SCHEMBL13801865

SCHEMBL13801865

Cc1c(/N=N/c2cccc3c2C(=O)c2ccccc2C3=O)c(O)n(CC(C)C)c(=O)c1C#N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.42
MEN1 O00255 10/20 0.42
KMT2A Q03164 10/20 0.42
KDM4E B2RXH2 3/20 0.40
THRB P10828 2/20 0.40
ALDH1A1 P00352 6/20 0.37
PKM P14618 1/20 0.37
MITF O75030 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 2/20 0.35
CYP2C9 P11712 2/20 0.35
TSHR P16473 1/20 0.35
HIF1A Q16665 1/20 0.35
LMNA P02545 1/20 0.34
MET P08581 1/20 0.34
GRM2 Q14416 1/20 0.33
MAPK1 P28482 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
SCHEMBL15586833 0.90 MAPT (0.44) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL15586780 0.88 MEN1 (0.47) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL12583679 0.87 MAPT (0.46) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL15586796 0.87 KMT2A (0.46) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL13142994 0.87 MEN1 (0.41) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL12583506 0.86 KMT2A (0.44) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL12583500 0.85 MEN1 (0.42) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL1139520 0.84 MEN1 (0.46) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL1139524 0.84 MEN1 (0.46) MAPTMEN1KMT2AKDM4ETHRB
SCHEMBL16628101 0.82 MAPT (0.40) MAPTMEN1KMT2AKDM4ETHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018114140-A1 INKS AND A PROCESS FOR INK-JET PRINTING TEXTILE FIBRE MATERIALS HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2018-06-28 WO disclosed
EP-2895561-B1 INKS AND A PROCESS FOR INK-JET PRINTING TEXTILE FIBRE MATERIALS HUNTSMAN ADVANCED MAT (SWITZERLAND) GMBH (CH) 2017-09-20 EP disclosed
US-9371463-B2 Inks and a process for ink-jet printing textile fibre materials HUNTSMAN INTERNATIONAL LLC (US) 2016-06-21 US disclosed
US-20150225584-A1 Inks and a Process for Ink-Jet Printing Textile Fibre Materials HUNTSMAN INTERNATIONAL LLC 2015-08-13 US disclosed
WO-2014040810-A1 INKS AND A PROCESS FOR INK-JET PRINTING TEXTILE FIBRE MATERIALS HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2014-03-20 WO disclosed
US-7544217-B2 Dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2009-06-09 US disclosed
US-20080263789-A1 Dye Mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-30 US disclosed