SCHEMBL3572078

SCHEMBL3572078

CCN(CC)CCNC(=O)C=Cc1cnc(N)c2c(-c3ccc(Br)cc3)csc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 16/20 0.70
FYN P06241 14/20 0.70
KDR P35968 13/20 0.70
CSF1R P07333 13/20 0.70
FGFR1 P11362 13/20 0.70
FLT1 P17948 13/20 0.70
MAP4K2 Q12851 13/20 0.70
MAP4K4 O95819 12/20 0.70
RET P07949 11/20 0.70
NTRK2 Q16620 11/20 0.70
TAOK1 Q7L7X3 11/20 0.70
BLK P51451 11/20 0.70
LYN P07948 11/20 0.70
NTRK1 P04629 10/20 0.70
STK3 Q13188 10/20 0.70
NEK2 P51955 10/20 0.70
NTRK3 Q16288 10/20 0.70
SRC P12931 10/20 0.70
RPS6KB1 P23443 10/20 0.70
SLK Q9H2G2 10/20 0.70

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
SCHEMBL3572073 1.00 LCK (0.70) LCKFYNKDRCSF1RFGFR1
SCHEMBL3530724 0.87 LCK (0.59) LCKFYNKDRCSF1RFGFR1
SCHEMBL3530726 0.87 LCK (0.59) LCKFYNKDRCSF1RFGFR1
SCHEMBL3530921 0.84 LCK (0.63) LCKFYNKDRCSF1RFGFR1
SCHEMBL3530915 0.84 LCK (0.63) LCKFYNKDRCSF1RFGFR1
SCHEMBL3566894 0.83 LCK (0.65) LCKFYNKDRCSF1RFGFR1
SCHEMBL3566898 0.83 LCK (0.65) LCKFYNKDRCSF1RFGFR1
SCHEMBL3533518 0.83 KDR (0.68) LCKFYNKDRCSF1RFGFR1
SCHEMBL3533519 0.83 KDR (0.68) LCKFYNKDRCSF1RFGFR1
SCHEMBL3531678 0.83 KDR (1.00) LCKFYNKDRCSF1RFGFR1

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 12/4885FYN 47/4885KDR 511/4885
US-20050026944-A1 Thienopyridine and furopyridine kinase inhibitors ABL1, ERBB2, LCK LCK 3/4885FYN 31/4885KDR 494/4885
US-20050043347-A1 Thienopyridine and furopyridine kinase inhibitors ABL1, ERBB2, LCK LCK 3/4885FYN 31/4885KDR 494/4885
US-20100069371-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABL1, ERBB2, LCK LCK 3/4885FYN 31/4885KDR 494/4885
US-20070155776-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABL1, ERBB2, LCK LCK 3/4885FYN 31/4885KDR 494/4885

“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.