SCHEMBL6847591

SCHEMBL6847591

O=S(=O)(O)c1ccccc1N1CCNC(C2CCCCC2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.39
MYC P01106 1/20 0.37
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
HRH4 Q9H3N8 2/20 0.34
MBTD1 Q05BQ5 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
CNR1 P21554 3/20 0.32
POLB P06746 1/20 0.32
EPHX2 P34913 3/20 0.32
ATM Q13315 1/20 0.32
NOTUM Q6P988 1/20 0.32

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
SCHEMBL2849210 0.79 MYC (0.45) HTR6MYCCYP3A4HRH4
SCHEMBL6288232 0.78 HTR6 (0.43) HTR6MYCNOTUM
Water SCHEMBL5996484 0.78 MYC (0.44) HTR6MYCCYP3A4HRH4
SCHEMBL6849293 0.78 HTR6 (0.43) HTR6MYCNOTUM
SCHEMBL6849062 0.76 RPS6KB1 (0.47) HTR6MYCNOTUM
SCHEMBL6847420 0.75 HDAC1 (0.41) HTR6MYC
SCHEMBL6848056 0.75 LATS1 (0.40) HTR6MYCNOTUM
SCHEMBL2851145 0.73 ADRB1 (0.41) HTR6MYC
SCHEMBL8632814 0.72 HTR6 (0.67) HTR6MYCTSHRCYP2C19
Water SCHEMBL6904877 0.71 HTR6 (0.65) HTR6MYCTSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100486574-C Remedies and/or preventives for nervous system disorders MITSUBISHI PHARMACEUTICALS INC (JP) 2009-05-13 CN claimed
CN-1946396-A Medicine for prevention and/or treatment of ischemic circulatory disease MITSUBISHI PHARMA CORP (JP) 2007-04-11 CN claimed
CN-1638773-A Pharmaceutical preparation containing aminobenzenesulfonic acid derivative as active ingredient MITSUBISHI PHARMA CORP (JP) 2005-07-13 CN claimed
CN-1533292-A Medicament inhititing sodium/calcium exchange system 三菱制药株式会社 2004-09-29 CN claimed
CN-1496261-A Remedies and/or preventives for diabetic ischemic heart diseases 三菱制药株式会社 2004-05-12 CN claimed
EP-1374868-A1 REMEDIES AND/OR PREVENTIVES FOR DIABETIC ISCHEMIC HEART DISEASES Mitsubishi Pharma Corporation (JP) 2004-01-02 EP claimed
CN-1434724-A Remedies and/or preventives for nervous system disorders MITSUBISHI PHARMACEUTICALS INC (JP) 2003-08-06 CN claimed
CN-100502861-C Medicament inhibiting sodium/calcium exchange system MITSUBISHI PHARMA CORP (JP) 2009-06-24 CN disclosed
CN-100496495-C Remedies and/or preventives for diabetic ischemic heart diseases MITSUBISHI PHARMA CORP (JP) 2009-06-10 CN disclosed
CN-100486574-C Remedies and/or preventives for nervous system disorders MITSUBISHI PHARMACEUTICALS INC (JP) 2009-05-13 CN disclosed
CN-1946396-A Medicine for prevention and/or treatment of ischemic circulatory disease MITSUBISHI PHARMA CORP (JP) 2007-04-11 CN disclosed
CN-1638773-A Pharmaceutical preparation containing aminobenzenesulfonic acid derivative as active ingredient MITSUBISHI PHARMA CORP (JP) 2005-07-13 CN disclosed
CN-1533292-A Medicament inhititing sodium/calcium exchange system 三菱制药株式会社 2004-09-29 CN disclosed
CN-1496261-A Remedies and/or preventives for diabetic ischemic heart diseases 三菱制药株式会社 2004-05-12 CN disclosed
EP-1374868-A1 REMEDIES AND/OR PREVENTIVES FOR DIABETIC ISCHEMIC HEART DISEASES Mitsubishi Pharma Corporation (JP) 2004-01-02 EP disclosed
CN-1434724-A Remedies and/or preventives for nervous system disorders MITSUBISHI PHARMACEUTICALS INC (JP) 2003-08-06 CN disclosed