SCHEMBL9922207

SCHEMBL9922207

O=C(Nc1ccc(N2C(=O)Cc3ccccc3C2=O)cc1)NS(=O)(=O)c1cc(Cl)c(Cl)s1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 3/20 0.44
GAA P10253 5/20 0.44
TLR9 Q9NR96 2/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
PTGER3 P43115 10/20 0.43
GRM1 Q13255 1/20 0.42
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER2 P43116 1/20 0.38
SCN2A Q99250 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL9922197 0.91 PTGER3 (0.44) CASP6PTGER3PTGER1PTGER4PTGER2
SCHEMBL9922192 0.90 PTGER3 (0.44) CASP6PTGER3PTGER1PTGER4PTGER2
SCHEMBL9922381 0.89 PTGER3 (0.38) GAAMEN1KMT2APTGER3
SCHEMBL9922375 0.89 PTGER3 (0.40) CASP6GAAMEN1KMT2APTGER3
SCHEMBL9922203 0.89 P2RY12 (0.40) GAATLR9MEN1KMT2APTGER3
SCHEMBL9922365 0.88 PTGER3 (0.40) GAAPKMMEN1KMT2APTGER3
SCHEMBL9922571 0.87 GAA (0.46) CASP6GAATLR9PKMMEN1
SCHEMBL9922189 0.87 KMT2A (0.45) GAAMEN1KMT2APTGER3
SCHEMBL9922406 0.87 CA2 (0.39) MEN1KMT2APTGER3CA12CA1
SCHEMBL9922407 0.86 PTGER3 (0.46) PTGER3CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524721-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 US 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 (2 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 CASP6 1824/4885GAA 2005/4885TLR9 101/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 CASP6 1814/4885GAA 1991/4885TLR9 100/4885

“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.