SCHEMBL5555427

SCHEMBL5555427

C[Si](C)(C)CCOC(Br)c1ccc2[nH]nc(C(=O)O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 9/20 0.46
PRKAA1 Q13131 9/20 0.46
PRKAB1 Q9Y478 9/20 0.46
HAO1 Q9UJM8 4/20 0.42
PRKAB2 O43741 8/20 0.41
PRKAA2 P54646 8/20 0.41
PRKAG3 Q9UGI9 8/20 0.41
PRKAG2 Q9UGJ0 8/20 0.41
GSK3B P49841 2/20 0.39
DYRK1A Q13627 4/20 0.37
WNT1 P04628 4/20 0.37
CLK2 P49760 1/20 0.37
CLK3 P49761 1/20 0.37
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL16534080 0.89 KDM4E (0.47) PRKAG1PRKAA1PRKAB1HAO1GSK3B
SCHEMBL4604844 0.87 KDM4E (0.51) GSK3BDYRK1AWNT1KDM4ESMN1; SMN2
SCHEMBL4604266 0.78 PRKAG1 (0.44) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL5550310 0.77 DYRK1A (0.44) PRKAG1PRKAA1PRKAB1HAO1PRKAB2
SCHEMBL5555429 0.76 DYRK1A (0.36) PRKAG1PRKAA1PRKAB1GSK3BDYRK1A
SCHEMBL6598584 0.75 PRKAG1 (0.55) PRKAG1PRKAA1PRKAB1HAO1PRKAB2
SCHEMBL16517744 0.72 RIPK1 (0.33) GSK3B
SCHEMBL5554387 0.70 DYRK1A (0.43) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL4604091 0.70 CHRNA7 (0.58)
SCHEMBL28811273 0.68 PRKAG1 (0.43) PRKAG1PRKAA1PRKAB1HAO1PRKAB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185187-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA SANOFI-AVENTIS (FR) 2007-08-09 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 (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-20070185187-A1 INDAZOLECARBOXAMIDE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF MALARIA CYP3A43, CYP3A5, SIRT5 PRKAG1 4426/4885PRKAA1 2207/4885PRKAB1 4441/4885

“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.