SCHEMBL19826562

SCHEMBL19826562

CO[C@@H](C)c1c(C(=O)OC(C)(C)CCCI)cnc2cc(Cl)nn12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 20/20 0.44
▸ BIRC3 Q13489 1/20 0.41
▸ HTR7 P34969 1/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.37
▸ SIGMAR1 Q99720 1/20 0.37
▸ FLT3 P36888 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
SCHEMBL18862728 0.89 MALT1 (0.46) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL17293034 0.85 MALT1 (0.51) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL17293032 0.85 MALT1 (0.51) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL25869771 0.80 MALT1 (0.57) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL18863076 0.78 MALT1 (0.37) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL17293010 0.77 MALT1 (0.55) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL17293012 0.77 MALT1 (0.55) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL18787821 0.77 MALT1 (0.55) MALT1BIRC3HTR7TMEM97SIGMAR1
SCHEMBL17293107 0.77 MALT1 (0.50) MALT1BIRC3
SCHEMBL17293109 0.77 MALT1 (0.50) MALT1BIRC3

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-10442808-B2 Pyrazolo pyrimidine derivatives and their use as MALT1 inhbitors NOVARTIS AG (CH) 2019-10-15 — — US disclosed
US-20180030061-A1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHBITORS NOVARTIS AG (CH) 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-20180030061-A1 NOVEL PYRAZOLO PYRIMIDINE DERIVATIVES AND THEIR USE AS MALT1 INHBITORS MMEL1, MALT1, FBP1 MALT1 2/4885BIRC3 13/4885HTR7 4728/4885
US-10442808-B2 Pyrazolo pyrimidine derivatives and their use as MALT1 inhbitors FBP1, MMEL1, MALT1 MALT1 3/4885BIRC3 40/4885HTR7 4706/4885

“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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