SCHEMBL1098708

SCHEMBL1098708

CC(=O)OCC(=O)Oc1c(Cl)cc(Cl)cc1C(=O)Cl

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 8/20 0.38
GAA P10253 7/20 0.38
KDM4E B2RXH2 7/20 0.38
GLA P06280 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL1096935 0.89 HPGD (0.45) HPGDUSP2ALDH1A1GAAKDM4E
Hydrochloric Acid SCHEMBL1098712 0.87 HPGD (0.44) HPGDUSP2ALDH1A1GAAKDM4E
SCHEMBL1097096 0.83 ABCB11 (0.41) ALDH1A1KDM4ESMN1; SMN2MAPTNPSR1
SCHEMBL10864147 0.73 KDM4E (0.48) HPGDALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL1098005 0.70 AKR1C4 (0.52) HPGDUSP2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10981786 0.70 CYP1A2 (0.45) HPGDUSP2ALDH1A1KDM4EMAPT
Hydrochloric Acid SCHEMBL1097098 0.69 AKR1C4 (0.50) HPGDUSP2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4642565 0.69 MAPT (0.48) HPGDALDH1A1GAAKDM4EMAPT
SCHEMBL4644463 0.69 MAPT (0.48) HPGDALDH1A1GAAKDM4EMAPT
SCHEMBL4642569 0.69 MAPT (0.48) HPGDALDH1A1GAAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2470894-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME Alltech, Inc. (US) 2012-07-04 EP claimed
WO-2011031562-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH, INC. (US) 2011-03-17 WO claimed
US-20110054132-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH, INC. (US) 2011-03-03 US claimed
EP-2470894-B1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH INC (US) 2021-12-29 EP disclosed
US-RE45274-E1 Synthetic mycotoxin adsorbents and methods of making and utilizing the same ALLTECH, INC. (US) 2014-12-02 US disclosed
US-8426541-B2 Synthetic mycotoxin adsorbents and methods of making and utilizing the same ALLTECH, INC. (US) 2013-04-23 US disclosed
US-20120214897-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH, INC. (US) 2012-08-23 US disclosed
EP-2470894-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME Alltech, Inc. (US) 2012-07-04 EP disclosed
US-8153737-B2 Synthetic mycotoxin adsorbents and methods of making and utilizing the same ALLTECH, INC. (US) 2012-04-10 US disclosed
WO-2011031562-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH, INC. (US) 2011-03-17 WO disclosed
US-20110054132-A1 SYNTHETIC MYCOTOXIN ADSORBENTS AND METHODS OF MAKING AND UTILIZING THE SAME ALLTECH, INC. (US) 2011-03-03 US disclosed