SCHEMBL19836633

SCHEMBL19836633

C=N/C(=N\C(N[C@@H]1C[C@@H]2CCCN2C(C)(C)C1)=C(/C)F)Nc1ccc(O[C@@H]2CCN(C3COC3)C[C@H]2F)c(C(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 4/20 0.33
▸ JAK2 O60674 1/20 0.31
▸ TSHR P16473 1/20 0.30

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
SCHEMBL15337706 0.76 LRRK2 (0.41) TBK1JAK2
SCHEMBL19527712 0.76 LRRK2 (0.41) TBK1JAK2
SCHEMBL18061447 0.76 LRRK2 (0.41) TBK1JAK2
SCHEMBL15337276 0.76 LRRK2 (0.41) TBK1JAK2
SCHEMBL17694844 0.73 TBK1 (0.39) TBK1JAK2
SCHEMBL17708412 0.68 SYK (0.51) TBK1JAK2
SCHEMBL18994970 0.66 DYRK1A (0.39) TBK1JAK2
SCHEMBL17708040 0.66 DYRK1A (0.39) TBK1JAK2
SCHEMBL15337709 0.66 LRRK2 (0.38) TBK1JAK2
SCHEMBL15337484 0.66 LRRK2 (0.38) TBK1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005777-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2018-06-26 — — US disclosed
US-20180030050-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2018-02-01 — — 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-10005777-B2 Protein kinase C inhibitors and uses thereof PRKCH, PRKCA, PRKCB TBK1 130/4885JAK2 335/4885TSHR 3710/4885
US-20180030050-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB TBK1 130/4885JAK2 335/4885TSHR 3710/4885

“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.

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