SCHEMBL7219155

SCHEMBL7219155

N[C@H]1CCN(Cc2cc3c(Cl)nccc3n2S(=O)(=O)c2ccccc2)C1=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.37
HTR6 P50406 9/20 0.35
PIK3C3 Q8NEB9 1/20 0.35
F2 P00734 3/20 0.34
PLG P00747 1/20 0.34
PLAT P00750 1/20 0.34
PROC P04070 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR7 P34969 1/20 0.33
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 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
Hydrochloric Acid SCHEMBL7213655 0.99 F10 (0.37) F10HTR6PIK3C3F2PLG
Hydrochloric Acid SCHEMBL7220664 0.99 F10 (0.37) F10HTR6PIK3C3F2PLG
SCHEMBL7219151 0.87 F10 (0.39) F10HTR6PIK3C3F2PLG
SCHEMBL7215798 0.81 F10 (0.40) F10HTR6F2PLGPLAT
Hydrochloric Acid SCHEMBL7536918 0.81 L3MBTL1 (0.41) HTR6PIK3C3KDM4EALDH1A1GAA
SCHEMBL27567561 0.81 F10 (0.35) F10HTR6PIK3C3F2PLG
SCHEMBL4386581 0.80 HTR6 (0.41) HTR6PIK3C3HTR1ADRD2HTR7
Hydrochloric Acid SCHEMBL7215912 0.80 F10 (0.40) F10HTR6F2PLGPLAT
SCHEMBL7214165 0.80 F10 (0.38) F10HTR6PIK3C3F2PLG
SCHEMBL16809574 0.77 TSHR (0.43) HTR6PIK3C3KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6602864-B1 Sulfonic acid or sulfonylamino N-(heteroaralkyl)-azaheterocyclylamide compounds AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-08-05 US disclosed
US-6281227-B1 INHIBITORS OF THE ACTIVITY OF FACTOR XA. AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-08-28 US disclosed
CN-1244798-A Sulfonic acid or sulfonylamino N-(heteroaralkyl)-azaheterocyclylamide compounds RHONE POULENC RORER PHARMA (US) 2000-02-16 CN disclosed