Ether

Ether

SCHEMBL4967124

CCC(C(=O)O)C(C(=O)O)(C(=O)O)C(=O)O.CCC(C(=O)O)C(C(=O)O)(C(=O)O)C(=O)O.CCOCC

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HSPD1 P10809 1/20 0.32
BLM P54132 1/20 0.32
HSPE1 P61604 1/20 0.32
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL29174 0.89 HSPD1 (0.36) MEN1HPGDRECQLKMT2AHSD17B10
Water SCHEMBL28414388 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
Water SCHEMBL4967126 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL28142494 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
Hydrochloric Acid SCHEMBL19371317 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL11749741 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL854470 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
Ammonia Solution, Strong SCHEMBL11691037 0.87 HSPD1 (0.35) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL11690921 0.80 HCAR2 (0.35) MEN1KMT2AHSD17B10ALDH1A1
SCHEMBL3828652 0.79 PRSS1 (0.32) MEN1HPGDRECQLKMT2AHSD17B10

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
EP-1511814-B1 WATER-BASED PIGMENT INKS, IMAGE RECORDING METHOD, AND IMAGE RECORDING SYSTEM DAINICHISEIKA COLOR CHEM (JP) 2008-06-25 EP claimed
EP-1511814-B1 WATER-BASED PIGMENT INKS, IMAGE RECORDING METHOD, AND IMAGE RECORDING SYSTEM DAINICHISEIKA COLOR CHEM (JP) 2008-06-25 EP disclosed
US-7361698-B2 Water-based pigment inks, image recording method, and image recording system DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2008-04-22 US disclosed
EP-1511814-A4 WATER-BASED PIGMENT INKS, IMAGE RECORDING METHOD, AND IMAGE RECORDING SYSTEM DAINICHISEIKA COLOR CHEM (JP) 2005-11-16 EP disclosed
EP-1511814-A1 WATER-BASED PIGMENT INKS, IMAGE RECORDING METHOD, AND IMAGE RECORDING SYSTEM DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 2005-03-09 EP disclosed
US-20040198869-A1 Water-based pigment inks, image recording method, and image recording system DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 2004-10-07 US disclosed
WO-2003102092-A1 WATER-BASED PIGMENT INKS, IMAGE RECORDING METHOD, AND IMAGE RECORDING SYSTEM DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2003-12-11 WO disclosed