SCHEMBL7215834

SCHEMBL7215834

CN[C@H]1CCN(Cc2ccc3nc(Cl)ccc3c2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.54
F2 P00734 6/20 0.44
PLG P00747 3/20 0.44
PROC P04070 2/20 0.39
PRSS1 P07477 2/20 0.39
KLKB1 P03952 1/20 0.39
PLAT P00750 1/20 0.39
KCNH2 Q12809 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CYP3A4 P08684 1/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
PGGT1B P53609 1/20 0.37

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
SCHEMBL7214115 0.92 F10 (0.53) F10F2PLGPROCPRSS1
SCHEMBL7214536 0.83 F10 (0.49) F10F2PLGPROCPRSS1
SCHEMBL7213626 0.82 F10 (0.49) F10F2PLGPROCPRSS1
Hydrochloric Acid SCHEMBL7219163 0.81 F10 (0.49) F10F2PLGPROCPRSS1
Hydrochloric Acid SCHEMBL7219164 0.81 F10 (0.49) F10F2PLGPROCPRSS1
SCHEMBL7213622 0.79 F10 (0.51) F10F2PLGPROCPRSS1
SCHEMBL7454004 0.78 F10 (0.43) F10F2PLGPROC
SCHEMBL7452322 0.78 F10 (0.39) F10F2PLGKCNH2CYP3A4
SCHEMBL7213599 0.78 F10 (0.49) F10F2PLGPROCPLAT
SCHEMBL7219970 0.78 F10 (0.39) F10F2PLGKCNH2CYP3A4

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 4 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
EP-0944386-B1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed
US-6281227-B1 INHIBITORS OF THE ACTIVITY OF FACTOR XA. AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-08-28 US disclosed
WO-2001039759-A2 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-06-07 WO disclosed