SCHEMBL1073758

SCHEMBL1073758

Cc1cccc(S(=O)(=O)n2c(=O)n(-c3ccc(C(C)(C)C#N)cc3)c3c4cc(Br)ccc4ncc32)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.52
MTOR P42345 16/20 0.52
PIK3CD O00329 6/20 0.52
PIK3CG P48736 5/20 0.52
PIK3CB P42338 4/20 0.51
PRKDC P78527 3/20 0.51
PIK3C2A O00443 2/20 0.51
PIK3C2B O00750 2/20 0.51
ATM Q13315 2/20 0.51
ATR Q13535 2/20 0.51
CHEK1 O14757 1/20 0.51
ABCB11 O95342 1/20 0.51
CSF1R P07333 1/20 0.51
MET P08581 1/20 0.51
PIK3R1 P27986 1/20 0.51
LTK P29376 1/20 0.51
CDK7 P50613 1/20 0.51
NEK2 P51955 1/20 0.51
JAK3 P52333 1/20 0.51
LIMK1 P53667 1/20 0.51

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
SCHEMBL1073153 0.94 PIK3CA (0.54) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1073147 0.93 PIK3CA (0.55) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1074229 0.93 PIK3CA (0.52) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1072887 0.92 PIK3CA (0.58) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1073856 0.91 PIK3CA (0.52) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1074199 0.91 PIK3CA (0.52) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1073968 0.91 PIK3CA (0.51) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1073234 0.90 PIK3CA (0.52) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1074292 0.90 PIK3CA (0.50) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1074302 0.87 PIK3CA (0.49) PIK3CAMTORPIK3CDPIK3CGPIK3CB

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-8637670-B2 Imidazo [4,5-C]quinoline derivatives and their use in the treatment of tumors and/or inflammation Piramal Enterprises Limited (IN) 2014-01-28 US claimed
EP-2448937-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION Piramal Life Sciences Limited (IN) 2012-05-09 EP claimed
US-20120108627-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION Piramal Enterprises Limited (IN) 2012-05-03 US claimed
WO-2011001212-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-01-06 WO claimed
US-8637670-B2 Imidazo [4,5-C]quinoline derivatives and their use in the treatment of tumors and/or inflammation Piramal Enterprises Limited (IN) 2014-01-28 US disclosed
EP-2448937-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION Piramal Life Sciences Limited (IN) 2012-05-09 EP disclosed
US-20120108627-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION Piramal Enterprises Limited (IN) 2012-05-03 US disclosed
WO-2011001212-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-01-06 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-20120108627-A1 IMIDAZO [4,5-C]QUINOLINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TUMORS AND/OR INFLAMMATION IL6, RPS6KA6, MTOR PIK3CA 91/4885MTOR 3/4885PIK3CD 120/4885

“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.