SCHEMBL16720652

SCHEMBL16720652

Cc1c(C(N)=O)ccc(B2OC(C)(C)C(C)(C)O2)c1C1CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ CCNC P24863 1/20 0.32
▸ CDK8 P49336 1/20 0.32
▸ HASPIN Q8TF76 1/20 0.32
▸ CDK19 Q9BWU1 1/20 0.32
▸ F11 P03951 2/20 0.32
▸ F2 P00734 1/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ PRSS2 P07478 1/20 0.32
▸ PRSS3 P35030 1/20 0.32

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
SCHEMBL1232113 0.83 ROCK2 (0.36) PARP1ROCK2CCNCCDK8HASPIN
SCHEMBL2825036 0.82 F11 (0.36) PARP1ROCK2F11F2PRSS1
SCHEMBL3823509 0.79 CCNC (0.34) PARP1ROCK2CCNCCDK8HASPIN
SCHEMBL15272044 0.79 F11 (0.34) ROCK2F11F2PRSS1PRSS2
SCHEMBL22468496 0.79 BTK (0.31) F11F2PRSS1PRSS2PRSS3
SCHEMBL1710393 0.79 BTK (0.31) F11F2PRSS1PRSS2PRSS3
SCHEMBL2029210 0.75 JAK2 (0.39) PARP1ROCK2F11F2PRSS1
SCHEMBL5706992 0.74 CDC7 (0.34) PARP1ROCK2CCNCCDK8HASPIN
SCHEMBL25436217 0.74 SIRT3 (0.37) PARP1
SCHEMBL4791070 0.72 CA1 (0.40) ROCK2F11F2PRSS1PRSS2

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-10570143-B2 Pyrazolopyrimidine compounds UNIVERSITY HEALTH NETWORK (CA) 2020-02-25 — — US disclosed
US-20190040074-A1 PYRAZOLOPYRIMIDINE COMPOUNDS UNIVERSITY HEALTH NETWORK (CA) 2019-02-07 — — US disclosed
EP-3068786-A1 PYRAZOLOPYRIMIDINE COMPOUNDS University Health Network (CA) 2016-09-21 — — EP disclosed
WO-2015070349-A1 PYRAZOLOPYRIMIDINE COMPOUNDS UNIVERSITY HEALTH NETWORK (CA) 2015-05-21 — — WO 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-10570143-B2 Pyrazolopyrimidine compounds CYP3A5, CYP3A7, DPYD PARP1 2322/4885ROCK2 3690/4885CCNC 4031/4885
US-20190040074-A1 PYRAZOLOPYRIMIDINE COMPOUNDS CYP3A5, CYP3A7, DPYD PARP1 2930/4885ROCK2 3509/4885CCNC 3894/4885

“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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