SCHEMBL1096938

SCHEMBL1096938

CC(=O)Oc1c(Cl)cc(C(=O)O)c(OC(C)=O)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
ALDH1A1 P00352 7/20 0.45
HSD17B10 Q99714 5/20 0.45
HPGD P15428 4/20 0.45
MAPK1 P28482 1/20 0.45
CFD P00746 2/20 0.42
TSHR P16473 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
ESR1 P03372 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
HMGB1 P09429 1/20 0.41
GGT1 P19440 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
BLM P54132 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
ABCB11 O95342 1/20 0.38
TPMT P51580 1/20 0.38
USP2 O75604 1/20 0.37

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
Hydrochloric Acid SCHEMBL1098710 0.98 KDM4E (0.44) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL10518784 0.86 KDM4E (0.45) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL9489920 0.84 KDM4E (0.44) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL1098005 0.82 AKR1C4 (0.52) KDM4EALDH1A1HSD17B10HPGDMAPK1
Hydrochloric Acid SCHEMBL1097098 0.81 AKR1C4 (0.50) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL13814014 0.77 ABCB11 (0.42) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL31612525 0.77 ABCB11 (0.42) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL3912774 0.76 KDM4E (0.46) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL9341005 0.76 TPMT (0.58) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL10520080 0.75 ABCB11 (0.38) KDM4EALDH1A1HSD17B10HPGDMAPK1

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