SCHEMBL22685973

SCHEMBL22685973

O=C1OC[C@@H](CO)N1c1ccc2[nH]nc(-c3cc4ccccc4[nH]3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITK Q08881 17/20 0.48
CHEK1 O14757 1/20 0.44
FGFR1 P11362 1/20 0.40
CLK2 P49760 1/20 0.40
CLK3 P49761 1/20 0.40
DYRK1A Q13627 1/20 0.40

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
SCHEMBL22685987 1.00 ITK (0.48) ITKCHEK1FGFR1CLK2CLK3
SCHEMBL22685974 1.00 ITK (0.48) ITKCHEK1FGFR1CLK2CLK3
SCHEMBL22685970 0.86 ITK (0.54) ITKCHEK1FGFR1
SCHEMBL22685950 0.86 ITK (0.54) ITKCHEK1FGFR1
SCHEMBL22685949 0.86 ITK (0.54) ITKCHEK1FGFR1
SCHEMBL22686006 0.84 ITK (0.49) ITKFGFR1
SCHEMBL22685939 0.84 ITK (0.49) ITKFGFR1
SCHEMBL22685938 0.84 ITK (0.49) ITKFGFR1
SCHEMBL22685988 0.83 ITK (0.51) ITKFGFR1
SCHEMBL22685986 0.83 ITK (0.51) ITKFGFR1

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-11396505-B2 Inhibitors of CaMKK2 and uses of same NEW YORK UNIVERSITY (US) 2022-07-26 US disclosed
US-11396505-B2 Inhibitors of CaMKK2 and uses of same NEW YORK UNIVERSITY (US) 2022-07-26 US disclosed
US-20200369656-A1 INHIBITORS OF CAMKK2 AND USES OF SAME NEW YORK UNIVERSITY 2020-11-26 US disclosed
US-20200369656-A1 INHIBITORS OF CAMKK2 AND USES OF SAME NEW YORK UNIVERSITY 2020-11-26 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-11396505-B2 Inhibitors of CaMKK2 and uses of same CAMKK2, CAMKK1, CAMK1 ITK 636/4885CHEK1 334/4885FGFR1 3980/4885
US-20200369656-A1 INHIBITORS OF CAMKK2 AND USES OF SAME CAMKK2, CAMKK1, CAMK1 ITK 636/4885CHEK1 334/4885FGFR1 3980/4885

“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.