SCHEMBL1718205

SCHEMBL1718205

Cc1ccc(S(=O)(=O)n2ccc3c(Br)c(Cl)cnc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
BRD4 O60885 4/20 0.44
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
PKM P14618 3/20 0.40
POLB P06746 2/20 0.39
HTT P42858 2/20 0.39
ALDH3A1 P30838 1/20 0.39
NOD1 Q9Y239 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
RAPGEF4 Q8WZA2 1/20 0.38
HSD11B1 P28845 1/20 0.38
PTPN11 Q06124 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTR6 P50406 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
SCHEMBL20840005 0.87 CYP2C19 (0.48) BRD4PKMHTTALDH1A1HTR6
SCHEMBL1356064 0.87 L3MBTL1 (0.51) L3MBTL1BRD4ABL1BCRPKM
SCHEMBL10125541 0.85 L3MBTL1 (0.49) L3MBTL1BRD4ABL1BCRPKM
SCHEMBL20535940 0.85 L3MBTL1 (0.49) L3MBTL1BRD4ABL1BCRPKM
SCHEMBL1357263 0.85 L3MBTL1 (0.49) L3MBTL1BRD4ABL1BCRPKM
SCHEMBL30081929 0.85 L3MBTL1 (0.49) L3MBTL1BRD4PKMPOLBHTT
SCHEMBL12346661 0.82 L3MBTL1 (0.47) L3MBTL1BRD4ABL1BCRPKM
SCHEMBL30509477 0.82 L3MBTL1 (0.51) L3MBTL1BRD4PKMPOLBHTT
SCHEMBL16052697 0.82 L3MBTL1 (0.51) L3MBTL1BRD4PKMPOLBHTT
SCHEMBL30081939 0.81 L3MBTL1 (0.46) L3MBTL1BRD4PKMPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108570048-B Substituted heteroaryl compounds, compositions and uses thereof 广东东阳光药业有限公司 2021-06-08 CN disclosed
US-8921376-B2 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-12-30 US disclosed
US-8921376-B2 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-12-30 US disclosed
US-8921376-B2 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-12-30 US disclosed
EP-1881983-B1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMA (US) 2012-01-11 EP disclosed
EP-1881983-B1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMA (US) 2012-01-11 EP disclosed
EP-2354139-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
EP-2354140-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
EP-2354140-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
EP-2354139-A1 Pyrrolopyridines useful as inhibitors of protein kinase Vertex Pharmaceuticals Incorporated (US) 2011-08-10 EP disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 US disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 US disclosed
US-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2007-06-14 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 (1 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-20070135466-A1 Pyrrolopyridines useful as inhibitors of protein kinase JAK2, JAK1, JAK3 L3MBTL1 3383/4885BRD4 748/4885ABL1 11/4885

“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.