SCHEMBL3530498

SCHEMBL3530498

COc1cc(-c2csc3ccnc(N)c23)ccc1NC(=O)OC(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 3/20 0.62
KDR P35968 18/20 0.53
ABL1 P00519 3/20 0.53
PIK3CD O00329 1/20 0.53
EGFR P00533 1/20 0.53
PIK3CA P42336 1/20 0.53
PIK3CG P48736 1/20 0.53
BACE1 P56817 1/20 0.53
PRKDC P78527 1/20 0.53
PI4KB Q9UBF8 1/20 0.53
KIT P10721 3/20 0.50
FLT3 P36888 3/20 0.50
PLK4 O00444 2/20 0.50
AURKA O14965 2/20 0.50
ROCK2 O75116 2/20 0.50
RPS6KA5 O75582 2/20 0.50
MAP4K4 O95819 2/20 0.50
CSF1R P07333 2/20 0.50
LYN P07948 2/20 0.50
RET P07949 2/20 0.50

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
SCHEMBL3381755 0.83 KDR (0.68) LCKKDRABL1KITFLT3
SCHEMBL3529621 0.83 LCK (0.57) LCKKDRABL1PIK3CDEGFR
SCHEMBL3529611 0.81 ABL1 (0.53) LCKKDRABL1PIK3CDEGFR
SCHEMBL3530962 0.79 LCK (0.54) LCKKDRABL1PIK3CDEGFR
SCHEMBL3530968 0.79 LCK (0.54) LCKKDRABL1PIK3CDEGFR
SCHEMBL3532902 0.77 LCK (1.00) LCKLYNSRC
SCHEMBL3530346 0.76 LCK (0.68) LCKKDRABL1PIK3CDEGFR
SCHEMBL3530344 0.76 LCK (0.68) LCKKDRABL1PIK3CDEGFR
SCHEMBL3529758 0.76 LCK (0.52) LCKKDRABL1PIK3CDEGFR
SCHEMBL3529756 0.76 LCK (0.52) LCKKDRABL1PIK3CDEGFR

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-8273736-B2 Thienopyridine and furopyridine kinase inhibitors ABBOTT LABORATORIES (US) 2012-09-25 US disclosed
US-7737160-B2 Thienopyridine and furopyridine kinase inhibitors ABBOTT LABORATORIES INC. (US) 2010-06-15 US disclosed
US-20100069371-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2010-03-18 US disclosed
EP-1648905-B1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LAB (US) 2008-12-31 EP disclosed
US-20070155776-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBVIE INC. 2007-07-05 US disclosed
US-7202363-B2 Thienopyridine and furopyridine kinase inhibitors ABBOTT LABORATORIES (US) 2007-04-10 US disclosed
US-20050043347-A1 Thienopyridine and furopyridine kinase inhibitors ABBVIE INC. 2005-02-24 US disclosed
US-20050026944-A1 Thienopyridine and furopyridine kinase inhibitors ABBOTT LABORATORIES 2005-02-03 US disclosed
US-20050020619-A1 Thienopyridine kinase inhibitors ABBOTT LABORATORIES 2005-01-27 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 (5 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-20050020619-A1 Thienopyridine kinase inhibitors ABL1, MAP4K2, MAP4K5 LCK 12/4885KDR 511/4885ABL1 1/4885
US-20050026944-A1 Thienopyridine and furopyridine kinase inhibitors ABL1, ERBB2, LCK LCK 3/4885KDR 494/4885ABL1 1/4885
US-20050043347-A1 Thienopyridine and furopyridine kinase inhibitors ABL1, ERBB2, LCK LCK 3/4885KDR 494/4885ABL1 1/4885
US-20100069371-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABL1, ERBB2, LCK LCK 3/4885KDR 494/4885ABL1 1/4885
US-20070155776-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABL1, ERBB2, LCK LCK 3/4885KDR 494/4885ABL1 1/4885

“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.