SCHEMBL6795136

SCHEMBL6795136

O=C1NC(=O)/C(=C/c2ccc3c(c2)CCO3)S1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.79
DYRK1B Q9Y463 5/20 0.79
CLK1 P49759 4/20 0.79
DYRK2 Q92630 3/20 0.79
CLK2 P49760 3/20 0.79
CLK3 P49761 2/20 0.79
CSNK2A2 P19784 1/20 0.79
CSNK2B P67870 1/20 0.79
CSNK2A1 P68400 1/20 0.79
GSK3B P49841 2/20 0.72
RAB9A P51151 2/20 0.59
PIK3CA P42336 1/20 0.59
PIK3CG P48736 1/20 0.59
NPC1 O15118 1/20 0.59
DYRK3 O43781 3/20 0.59
IGF1R P08069 1/20 0.54
PIM1 P11309 7/20 0.53
PIM2 Q9P1W9 7/20 0.53
PIM3 Q86V86 2/20 0.53
PDE4B Q07343 1/20 0.53

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
SCHEMBL2884580 1.00 DYRK1A (0.79) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL2884578 1.00 DYRK1A (0.79) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL8187615 0.90 DYRK1A (0.72) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL8187617 0.90 DYRK1A (0.72) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL8188586 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL16762283 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL16762270 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL8188589 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL13196839 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2
SCHEMBL16762284 0.88 DYRK1A (1.00) DYRK1ADYRK1BCLK1DYRK2CLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20040092561-A1 Azolidinone-vinyl fused -benzene derivatives APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-05-13 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 (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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX DYRK1A 3161/4885DYRK1B 2749/4885CLK1 4202/4885
US-20040092561-A1 Azolidinone-vinyl fused -benzene derivatives BRCA1, ZAP70, ZYX DYRK1A 3475/4885DYRK1B 3208/4885CLK1 4099/4885

“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.