SCHEMBL6220745

SCHEMBL6220745

Oc1nncc2ncc(Br)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 6/20 0.37
DYRK1B Q9Y463 5/20 0.35
AURKA O14965 2/20 0.34
JAK2 O60674 2/20 0.34
MAP4K4 O95819 2/20 0.34
IGF1R P08069 2/20 0.34
FGFR1 P11362 2/20 0.34
FLT1 P17948 2/20 0.34
KDR P35968 2/20 0.34
CLK2 P49760 2/20 0.34
JAK3 P52333 2/20 0.34
LIMK1 P53667 2/20 0.34
CDK5 Q00535 2/20 0.34
MAP4K2 Q12851 2/20 0.34
NTRK2 Q16620 2/20 0.34
AURKB Q96GD4 2/20 0.34
CLK4 Q9HAZ1 2/20 0.34
CHEK1 O14757 1/20 0.34
DAPK3 O43293 1/20 0.34
PAK4 O96013 1/20 0.34

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
SCHEMBL6219449 0.74 MAPT (0.38) DYRK1ADYRK1BAURKAJAK2MAP4K4
SCHEMBL30505990 0.74 MAPT (0.38) DYRK1ADYRK1BAURKAJAK2MAP4K4
SCHEMBL6219191 0.68 MEN1 (0.38) DYRK1AHTTKMT2AFLT3CSNK2A1
SCHEMBL29677534 0.68 MEN1 (0.38) DYRK1AHTTKMT2AFLT3CSNK2A1
SCHEMBL934055 0.67 DYRK1A (0.52) DYRK1ADYRK1BAURKAJAK2MAP4K4
SCHEMBL29470857 0.67 DYRK1A (0.52) DYRK1ADYRK1BAURKAJAK2MAP4K4
SCHEMBL24253016 0.67 DYRK1A (0.36) DYRK1AHTTKMT2AMAPT
SCHEMBL6223301 0.67
SCHEMBL396021 0.67 PLAU (0.39) DYRK1ACDK5PRKACACSNK1A1HTT
SCHEMBL23246961 0.67 MEN1 (0.40) DYRK1ADYRK1BAURKAJAK2MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969729-B2 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2005-11-29 US claimed
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S 2003-06-19 US claimed
US-6977261-B2 Azaisoquinoline derivatives as matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2005-12-20 US disclosed
US-6969729-B2 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2005-11-29 US disclosed
EP-1539709-A1 AZAISOQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2005-06-15 EP disclosed
US-20040038961-A1 Azaisoquinoline derivatives as matrix metalloproteinase inhibitors BUNKER AMY MAE (US) 2004-02-26 US disclosed
WO-2004014866-A1 AZAISOQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S 2003-06-19 US disclosed
EP-0432648-B1 Isatine derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-08-02 EP disclosed
US-5198461-A Isatine derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-03-30 US disclosed
EP-0432648-A2 Isatine derivatives, their preparation and use NEUROSEARCH A/S (DK) 1991-06-19 EP 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-20030114513-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 DYRK1A 3165/4885DYRK1B 4361/4885AURKA 1354/4885
US-20040038961-A1 Azaisoquinoline derivatives as matrix metalloproteinase inhibitors MMP13, MMP9, MMP1 DYRK1A 4553/4885DYRK1B 4446/4885AURKA 3960/4885

“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.