SCHEMBL14738121

SCHEMBL14738121

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nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 12/20 0.53
CTSS P25774 11/20 0.53
CTSL P07711 4/20 0.42
CTSB P07858 3/20 0.42
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39

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
SCHEMBL14738854 0.88 CTSS (0.46) CTSKCTSSCTSLCTSBTSHR
SCHEMBL2378971 0.84 CTSK (0.44) CTSKCTSSCTSLCTSBKMT2A
SCHEMBL2491119 0.84 CTSK (0.44) CTSKCTSSCTSLCTSBKMT2A
SCHEMBL14755238 0.83 CTSK (0.41) CTSKCTSSCTSLCTSB
SCHEMBL14751034 0.83 CTSK (0.47) CTSKCTSSTSHRKMT2AITGB3
SCHEMBL20163977 0.82 CTSK (0.46) CTSKCTSSTSHRKMT2AITGB3
SCHEMBL18359423 0.82 CTSK (0.46) CTSKCTSSTSHRKMT2AITGB3
SCHEMBL14737063 0.82 JAK2 (0.45) CTSKCTSSCTSLCTSB
SCHEMBL18368260 0.81 CTSK (0.45) CTSKCTSSTSHRKMT2AITGB3
SCHEMBL2377722 0.81 JAK1 (0.41) CTSKCTSSCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 US disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 US disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 CTSK 876/4885CTSS 1854/4885CTSL 1772/4885

“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.