SCHEMBL1787523

SCHEMBL1787523

CC(=O)Nc1nc2ccc(-c3nn(C(C)C)c4ncnc(N)c34)cc2s1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.62
PIK3C2B O00750 1/20 0.62
PIK3CG P48736 17/20 0.59
PIK3CA P42336 14/20 0.57
PIK3CB P42338 14/20 0.57
MTOR P42345 13/20 0.57
ABL1 P00519 13/20 0.57
SRC P12931 13/20 0.57
PRKDC P78527 13/20 0.57
EGFR P00533 12/20 0.57
HCK P08631 12/20 0.57
KDR P35968 12/20 0.57
EPHB4 P54760 12/20 0.57
PI4KB Q9UBF8 6/20 0.57
BACE1 P56817 1/20 0.56

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
SCHEMBL18799891 0.93 PIK3CD (0.57) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL8012344 0.92 PIK3CD (0.56) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL8006833 0.91 KDR (0.56) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL8006218 0.90 SRC (0.55) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL12651288 0.90 ABL1 (0.55) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL12422410 0.88 PIK3CG (0.61) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL1785138 0.88 SRC (0.62) PIK3CDPIK3CGPIK3CAPIK3CBMTOR
SCHEMBL12607037 0.85 PIK3CG (0.72) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL8008773 0.85 SRC (0.59) PIK3CDPIK3CGPIK3CAPIK3CBMTOR
SCHEMBL8012348 0.85 SRC (0.56) PIK3CDPIK3CGPIK3CAPIK3CBMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9637492-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-05-02 US disclosed
US-9637492-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-05-02 US disclosed
US-9637492-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-05-02 US disclosed
US-20150225407-A1 Benzothiazole Kinase Inhibitors and Methods of Use INTELLIKINE LLC 2015-08-13 US disclosed
US-20150225407-A1 Benzothiazole Kinase Inhibitors and Methods of Use INTELLIKINE LLC 2015-08-13 US disclosed
US-20150225407-A1 Benzothiazole Kinase Inhibitors and Methods of Use INTELLIKINE LLC 2015-08-13 US disclosed
US-8993580-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2015-03-31 US disclosed
US-8993580-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2015-03-31 US disclosed
US-8993580-B2 Benzothiazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2015-03-31 US disclosed
US-20110124641-A1 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-05-26 US disclosed
US-20110124641-A1 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-05-26 US disclosed
US-20110124641-A1 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-05-26 US disclosed
WO-2009114874-A2 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2009-09-17 WO disclosed
WO-2009114874-A2 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2009-09-17 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 (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-20110124641-A1 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE MTOR, PDPK1, PIKFYVE PIK3CD 22/4885PIK3C2B 24/4885PIK3CG 33/4885
US-20150225407-A1 Benzothiazole Kinase Inhibitors and Methods of Use MTOR, PDPK1, PIKFYVE PIK3CD 22/4885PIK3C2B 24/4885PIK3CG 33/4885

“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.