SCHEMBL17305966

SCHEMBL17305966

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nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CTSK P43235 9/20 0.42
▸ ATM Q13315 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CTSS P25774 4/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL25601716 1.00 CA1 (0.42) CA1CA2CA7CTSKATM
SCHEMBL13964494 1.00 CA1 (0.42) CA1CA2CA7CTSKATM
SCHEMBL3462484 0.87 CA1 (0.42) CA1CA2CA7CTSKATM
SCHEMBL3096508 0.87 CA1 (0.42) CA1CA2CA7CTSKATM
SCHEMBL2329376 0.87 CA1 (0.42) CA1CA2CA7CTSKATM
SCHEMBL2104058 0.87 CYP2D6 (0.45) CA1CA2CA7CTSKATM
SCHEMBL4671387 0.87 CYP2D6 (0.45) CA1CA2CA7CTSKATM
SCHEMBL4671380 0.87 CYP2D6 (0.45) CA1CA2CA7CTSKATM
SCHEMBL23833082 0.85 CA1 (0.41) CA1CA2CA7CTSKATM
SCHEMBL14471734 0.85 CA1 (0.41) CA1CA2CA7CTSKATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180099978-A1 PROCESSES OF PREPARING A JAK1 INHIBITOR AND NEW FORMS THERETO INCYTE CORPORATION 2018-04-12 — — US disclosed
US-9802957-B2 Processes of preparing a JAK1 inhibitor and new forms thereto INCYTE CORPORATION (US) 2017-10-31 — — US disclosed
US-20150344497-A1 PROCESSES OF PREPARING A JAK1 INHIBITOR AND NEW FORMS THERETO INCYTE CORPORATION (US) 2015-12-03 — — 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-20180099978-A1 PROCESSES OF PREPARING A JAK1 INHIBITOR AND NEW FORMS THERETO JAK1, JAK2, JAK3 CA1 4464/4885CA2 4653/4885CA7 4453/4885
US-20150344497-A1 PROCESSES OF PREPARING A JAK1 INHIBITOR AND NEW FORMS THERETO JAK1, JAK2, JAK3 CA1 4464/4885CA2 4653/4885CA7 4453/4885

“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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