SCHEMBL6848056

SCHEMBL6848056

O=S(=O)(O)c1ccccc1N1CCNC(C(F)(F)F)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 4/20 0.40
HTR6 P50406 3/20 0.40
MYC P01106 1/20 0.38
LATS2 Q9NRM7 1/20 0.36
ATR Q13535 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ADRB1 P08588 1/20 0.32
PRKCQ Q04759 1/20 0.32
NOTUM Q6P988 1/20 0.32
HTR2C P28335 1/20 0.31
WEE1 P30291 1/20 0.31
DRD2 P14416 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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 0.81 MYC (0.45) HTR6MYCPRKCQHTR2CDRD2
Water SCHEMBL5996484 0.80 MYC (0.44) HTR6MYCPRKCQHTR2CDRD2
SCHEMBL6849293 0.80 HTR6 (0.43) HTR6MYCADRB1NOTUMDRD2
SCHEMBL6288232 0.80 HTR6 (0.43) HTR6MYCADRB1NOTUMDRD2
SCHEMBL6849062 0.78 RPS6KB1 (0.47) HTR6MYCPRKCQNOTUM
SCHEMBL6847420 0.77 HDAC1 (0.41) HTR6MYCADRB1PRKCQDRD2
SCHEMBL6847591 0.75 HTR6 (0.39) HTR6MYCNOTUM
SCHEMBL2851145 0.75 ADRB1 (0.41) HTR6MYCADRB1DRD2
SCHEMBL8632814 0.74 HTR6 (0.67) HTR6MYCADRB1DRD2
Water SCHEMBL6904877 0.73 HTR6 (0.65) HTR6MYCADRB1DRD2

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