SCHEMBL3496932

SCHEMBL3496932

COc1ccc(-c2ccc3sc(C(=O)O)cc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 8/20 0.55
DYRK1A Q13627 4/20 0.55
DYRK1B Q9Y463 1/20 0.55
F9 P00740 5/20 0.50
F10 P00742 3/20 0.50
HDAC6 Q9UBN7 1/20 0.49
BCL2L1 Q07817 1/20 0.49
HDAC1 Q13547 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
CLK2 P49760 2/20 0.46
CLK4 Q9HAZ1 2/20 0.46

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
SCHEMBL1867721 0.88 CLK1 (0.68) CLK1DYRK1ADYRK1BBCL2L1CLK2
SCHEMBL3498352 0.85 MCL1 (0.50) CLK1DYRK1ADYRK1BF9F10
SCHEMBL3497047 0.83 BCL2L1 (0.53) CLK1DYRK1ADYRK1BF9F10
SCHEMBL121331 0.83 F9 (0.67) CLK1DYRK1ADYRK1BF9F10
SCHEMBL22777736 0.83 F9 (0.67) CLK1DYRK1ADYRK1BF9F10
SCHEMBL3498109 0.82 F9 (0.50) CLK1F9F10BCL2L1NR1H4
SCHEMBL3498640 0.82 MAPT (0.52) CLK1DYRK1ADYRK1BF9F10
SCHEMBL3498127 0.82 CLK1 (0.60) CLK1DYRK1ADYRK1BHDAC6HDAC1
SCHEMBL4601842 0.82 F9 (0.56) CLK1DYRK1ADYRK1BF9F10
SCHEMBL3498018 0.80 BCL2L1 (0.53) CLK1DYRK1ADYRK1BF9F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 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 (1 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 CLK1 3974/4885DYRK1A 3028/4885DYRK1B 2663/4885

“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.