SCHEMBL6358445

SCHEMBL6358445

COc1ccc(Cl)cc1C(=O)OC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 1/20 0.53
POLB P06746 3/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
ALDH1A1 P00352 3/20 0.47
HPGD P15428 1/20 0.47
KCNMA1 Q12791 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL6358441 0.89 MAPT (0.60) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL27660170 0.85 TP53 (0.51) MEN1KMT2AMAPTTSHRNPC1
SCHEMBL6103175 0.83 POLB (0.66) MAPTTSHRPOLBLMNAALDH1A1
SCHEMBL11096709 0.81 ALDH1A1 (0.55) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL446340 0.81 SLC6A3 (0.60) KMT2AMAPTTSHRNPC1LMNA
SCHEMBL2946505 0.79 SLC6A3 (0.68) MEN1KMT2AMAPTTSHRNPC1
SCHEMBL1095516 0.79 MEN1 (0.64) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL29812845 0.79 MEN1 (0.64) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL28337798 0.79 KMT2A (0.60) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL3077888 0.78 RAB9A (0.62) KMT2AMAPTTSHRNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1117409-B1 BENZENESULFONYL(THIO)UREAS IN COMBINATION WITH BETA-BLOCKERS FOR THE TREATMENT OF DYSFUNCTIONS OF THE AUTONOMOUS NERVOUS SYSTEM AVENTIS PHARMA GMBH (DE) 2005-01-26 EP disclosed
EP-1401419-A1 BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT OF SEPTIC SHOCK AND SIRS Aventis Pharma Deutschland GmbH (DE) 2004-03-31 EP disclosed
US-20030083385-A1 Use of benzenesulfonyl (thioureas or ure as) for treating of septic shock or gene ralized inflammatory syndrome GERLACH UWE (DE) 2003-05-01 US disclosed
WO-2003000244-A1 BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT OF SEPTIC SHOCK AND SIRS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-01-03 WO disclosed
US-6414030-B1 1-((5-(2-(5-TERT-BUTYL-2-METHOXYBENZAMIDO)ETHYL)-2-METHOXYPHEN YL)-SULFONYL)-3-METHYLTHIOUREA AND PROPANOLOL FOR EXAMPLE AVENTIS PHARMA DEUTSCHLAND, GMBH (DE) 2002-07-02 US disclosed
US-20020082300-A1 USE OF BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT AND PROPHYLAXIS OF DYSFUNCTIONS OF THE AUTONOMOUS NERVOUS SYSTEM AND USE OF BENZENESULFONYL(THIO)UREAS IN COMBINATION WITH BETA-RECEPTOR BLOCKERS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-06-27 US disclosed
EP-1117409-A2 USE OF BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT OF DYSFUNCTIONS OF THE AUTONOMOUS NERVOUS SYSTEM Aventis Pharma Deutschland GmbH (DE) 2001-07-25 EP disclosed
WO-2000015204-A2 USE OF BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT AND PROPHYLAXIS OF DYSFUNCTIONS OF THE AUTONOMOUS NERVOUS SYSTEM AND USE OF BENZENESULFONYL(THIO)UREAS IN COMBINATION WITH BETA-RECEPTOR BLOCKERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-03-23 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-20020082300-A1 USE OF BENZENESULFONYL(THIO)UREAS FOR THE TREATMENT AND PROPHYLAXIS OF DYSFUNCTIONS OF THE AUTONOMOUS NERVOUS SYSTEM AND USE OF BENZENESULFONYL(THIO)UREAS IN COMBINATION WITH BETA-RECEPTOR BLOCKERS UTS2R, TST, SIGMAR1 MEN1 4394/4885KMT2A 3432/4885MAPT 2852/4885
US-20030083385-A1 Use of benzenesulfonyl (thioureas or ure as) for treating of septic shock or gene ralized inflammatory syndrome UTS2R, EIF2S1, TST MEN1 4700/4885KMT2A 3903/4885MAPT 4798/4885

“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.