SCHEMBL1890174

SCHEMBL1890174

Cc1cc(Cl)cc(Cl)c1OCC(=O)O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.57
TDP1 Q9NUW8 3/20 0.55
MRGPRX4 Q96LA9 1/20 0.55
TSHR P16473 2/20 0.53
HPGD P15428 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
ALOX15 P16050 1/20 0.53
ALOX12 P18054 1/20 0.53
ATM Q13315 1/20 0.53
HSD17B10 Q99714 1/20 0.53
MCL1 Q07820 1/20 0.53
KMT2A Q03164 1/20 0.51
PKM P14618 1/20 0.50
HTT P42858 1/20 0.50
HIF1A Q16665 1/20 0.46
THRB P10828 1/20 0.45

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
SCHEMBL11570516 0.91 KDM4E (0.55) KDM4ETDP1TSHRHPGDMAPT
SCHEMBL481443 0.87 KMT2A (0.66) KDM4ETDP1TSHRHPGDALDH1A1
Hydrochloric Acid SCHEMBL10388885 0.85 KMT2A (0.63) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL9503906 0.82 KDM4E (0.64) KDM4ETDP1MRGPRX4TSHRHPGD
SCHEMBL2300012 0.81 KDM4E (0.47) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL10981785 0.81 KMT2A (0.58) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL113262 0.80 KMT2A (0.61) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL11574148 0.79 KDM4E (0.68) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL4626719 0.78 TDP1 (0.50) KDM4ETDP1TSHRHPGDALDH1A1
SCHEMBL2556737 0.77 TDP1 (0.49) KDM4ETDP1TSHRHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170332633-A1 DOUBLE SALT IONIC LIQUIDS OF HERBICIDES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2017-11-23 US disclosed
US-20170332633-A1 DOUBLE SALT IONIC LIQUIDS OF HERBICIDES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2017-11-23 US disclosed
US-9012363-B2 Granular controlled release agrochemical compositions and process for the preparation thereof EVERRIS INTERNATIONAL B.V. (NL) 2015-04-21 US disclosed
EP-1928231-B1 GRANULAR CONTROLLED RELEASE AGROCHEMICAL COMPOSITIONS AND PROCESS FOR THE PREPARATION THEREOF EVERRIS INTERNAT B V (NL) 2014-03-12 EP disclosed
US-20130310255-A1 GRANULAR CONTROLLED RELEASE AGROCHEMICAL COMPOSITIONS AND PROCESS FOR THE PREPARATION THEREOF OMS INVESTMENTS, INC. 2013-11-21 US disclosed
US-8497229-B2 Granular controlled release agrochemical compositions and process for the preparation thereof EVERRIS INTERNATIONAL B.V. (NL) 2013-07-30 US disclosed
EP-2545775-A2 Granular controlled release agrochemical compositions and process for the preparation thereof Everris International B.V. (NL) 2013-01-16 EP disclosed
CN-101941903-B Method for producing 2-methyl-4-MCPA JIANGSU GOOD HARVEST WEIEN AGROCHEMICAL CO LTD 2012-11-07 CN disclosed
CN-102336654-A Chlorination method of phenoxyacetic acid and derivatives thereof DALIAN RES AND DESIGN INST OF CHEMICAL INDUSTRY 2012-02-01 CN disclosed
US-20110111956-A1 Granular Controlled Release Agrochemical Compositions and Process for the Preparation Thereof OMS INVESTMENTS, INC. (US) 2011-05-12 US disclosed
CN-101941903-A Method for producing 2-methyl-4-MCPA JIANGSU GOOD HARVEST WEIEN AGROCHEMICAL CO LTD 2011-01-12 CN disclosed
CN-101500410-A Granular controlled release agrochemical compositions and process for preparing same OMS INVEST INC (US) 2009-08-05 CN disclosed
EP-1928231-A2 GRANULAR CONTROLLED RELEASE AGROCHEMICAL COMPOSITIONS AND PROCESS FOR THE PREPARATION THEREOF OMS Investments, Inc. (US) 2008-06-11 EP disclosed
WO-2007041234-A2 GRANULAR CONTROLLED RELEASE AGROCHEMICAL COMPOSITIONS AND PROCESS FOR THE PREPARATION THEREOF OMS INVESTMENTS, INC. (US) 2007-04-12 WO disclosed
US-20070072775-A1 Granular controlled release agrochemical compositions and process for the preparation thereof OMS INVESTMENTS, INC. (US) 2007-03-29 US disclosed
US-20060276339-A1 Methods and compositions for increasing the efficacy of biologically-active ingredients BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2006-12-07 US disclosed
EP-0539462-A1 A METHOD FOR PREPARING 4-CHLORO-2-METHYLPHENOXYALKANOIC ACIDS KVK AGRO A/S (DK) 1993-05-05 EP disclosed
WO-1992001663-A1 A METHOD FOR PREPARING 4-CHLORO-2-METHYLPHENOXYALKANOIC ACIDS KVK AGRO A/S (DK) 1992-02-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170332633-A1 DOUBLE SALT IONIC LIQUIDS OF HERBICIDES SLC6A9, DDT, SLC6A5 KDM4E 2198/4885TDP1 1769/4885MRGPRX4 3703/4885
US-20060276339-A1 Methods and compositions for increasing the efficacy of biologically-active ingredients ENPP1, ENPP3, SMPD1 KDM4E 1139/4885TDP1 696/4885MRGPRX4 3227/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.