SCHEMBL6184895

SCHEMBL6184895

COc1ccccc1N1CCN(C(=O)C(Cl)(Cl)Cl)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.61
TSHR P16473 3/20 0.60
ALDH1A1 P00352 5/20 0.60
LMNA P02545 3/20 0.60
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
POLB P06746 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
PKM P14618 1/20 0.59
HPGDS O60760 1/20 0.59
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
DRD2 P14416 1/20 0.56
DRD3 P35462 1/20 0.56
RAB9A P51151 1/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL9272910 0.87 TSHR (0.64) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL4658334 0.86 AKR1C3 (0.61) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL1423195 0.84 AKR1C3 (0.66) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL16026545 0.83 PKM (0.74) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL27829788 0.83 AKR1C3 (0.83) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL7793932 0.82 AKR1C3 (0.68) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL3904994 0.82 KMT2A (0.68) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL6981817 0.81 CYP2C9 (0.45) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL8362372 0.81 TSHR (0.68) AKR1C3TSHRALDH1A1LMNAKMT2A
SCHEMBL30747784 0.81 TSHR (0.68) AKR1C3TSHRALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083588-B1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO LTD (CN) 2020-12-09 EP disclosed
EP-3134392-B1 SULFONAMIDE DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2019-01-02 EP disclosed
US-9840482-B2 Sulfonamide derivatives and pharmaceutical applications thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-12-12 US disclosed
US-9663498-B2 Aromatic heterocyclic compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-05-30 US disclosed
US-9663498-B2 Aromatic heterocyclic compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-05-30 US disclosed
US-20170037017-A1 Sulfonamide Derivatives And Pharmaceutical Applications Thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-02-09 US disclosed
US-20160251339-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-09-01 US disclosed
EP-1049679-B1 SULPHONAMIDE DERIVATIVES FOR TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM PLC (GB) 2005-06-01 EP disclosed
EP-0994862-B1 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2005-06-01 EP disclosed
US-20040047828-A1 Ectoin or ection derivatives and surfactants MERCK PATENT GMBH (DE) 2004-03-11 US disclosed
US-20040034036-A1 N-(3,5-dichloro-2-methoxyphenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide SMITHKLINE BEECHMAN P.L.C. (GB) 2004-02-19 US disclosed
WO-2003072198-A1 THE USE OF A BENZENESULFONAMIDE COMPOUND IN THE TREATMENT OF OBESITY GLAXO GROUP LIMITED (GB) 2003-09-04 WO disclosed
EP-1313720-A1 N-(3,5-DICHLORO-2-METHOXYPHENYL)-4-METHOXY-3-PIPERAZIN-1-YL-BENZENESULFONAMIDE SMITHKLINE BEECHAM PLC (GB) 2003-05-28 EP disclosed
US-6548504-B1 Compounds SMITHKLINE BEECHAM P.L.C. (GB) 2003-04-15 US disclosed
WO-2002018358-A1 N-(3,5-DICHLORO-2-METHOXYPHENYL)-4-METHOXY-3-PIPERAZIN-1-YL-BENZENESULFONAMIDE SMITHKLINE BEECHAM P.L.C. (GB) 2002-03-07 WO disclosed
US-6316450-B1 PIPERAZINE COMPOUNDS FOR TREATING DEPRESSION AND ANXIETY SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-13 US disclosed
EP-1049679-A2 SULPHONAMIDE DERIVATIVES FOR TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM PLC (GB) 2000-11-08 EP disclosed
EP-0994862-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2000-04-26 EP disclosed
WO-1999037623-A2 SULPHONAMIDE DERIVATIVES FOR TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM PLC (GB) 1999-07-29 WO disclosed
WO-1999002502-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 1999-01-21 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 (4 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-20160251339-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS MAPT, APP, PSEN1 AKR1C3 194/4885TSHR 3458/4885ALDH1A1 1342/4885
US-20170037017-A1 Sulfonamide Derivatives And Pharmaceutical Applications Thereof HTR6, SLC6A4, HTR2A AKR1C3 1080/4885TSHR 610/4885ALDH1A1 1780/4885
US-20040047828-A1 Ectoin or ection derivatives and surfactants EFNA1, CERT1, LRAT AKR1C3 1300/4885TSHR 393/4885ALDH1A1 2485/4885
US-20040034036-A1 N-(3,5-dichloro-2-methoxyphenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide PMP22, CNR2, SNCA AKR1C3 2457/4885TSHR 2110/4885ALDH1A1 964/4885

“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.