SCHEMBL3568076

SCHEMBL3568076

COc1ccccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2ncc(-c3cc(C(=O)O)n(S(=O)(=O)c4ccc(C)cc4)n3)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.47
MAPT P10636 8/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TSHR P16473 2/20 0.44
KMT2A Q03164 9/20 0.42
MEN1 O00255 6/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.38
NOD2 Q9HC29 1/20 0.38
NOD1 Q9Y239 1/20 0.38
POLB P06746 2/20 0.38
RECQL P46063 1/20 0.38
BRD4 O60885 1/20 0.38
MAPK1 P28482 2/20 0.37
HSD17B10 Q99714 1/20 0.37
EGLN1 Q9GZT9 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
SCHEMBL3572307 0.91 PTPN11 (0.42) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL13010217 0.83 PTPN11 (0.55) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL3571375 0.83 MAPT (0.51) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL3567189 0.82 MAPT (0.45) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL13342637 0.81 PTPN11 (0.51) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL12763220 0.81 TSHR (0.53) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL5068693 0.81 PTPN11 (0.43) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL5060929 0.81 PTPN11 (0.43) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL1516691 0.79 PTPN11 (0.47) PTPN11MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL3568791 0.79 PTPN11 (0.47) PTPN11MAPTSMN1; SMN2TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
EP-2134343-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-12-23 EP disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO 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-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS MAP4K2, PDXK, MAP4K1 PTPN11 1303/4885MAPT 1385/4885SMN1; SMN2 2843/4885

“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.