SCHEMBL9882333

SCHEMBL9882333

CCC1CN(c2ccc(C(F)(F)F)c(-c3n[nH]c4ncccc34)n2)CCC1C#N

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRKCQ Q04759 10/20 0.41
▸ PRKCD Q05655 7/20 0.41
▸ MAPT P10636 1/20 0.36
▸ PRKCA P17252 2/20 0.34
▸ PRKCB P05771 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ PRKCE Q02156 1/20 0.34
▸ AXL P30530 7/20 0.34
▸ CTSS P25774 2/20 0.33

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
SCHEMBL9882276 0.92 PRKCQ (0.44) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9882334 0.89 PRKCQ (0.44) PRKCQPRKCDMAPTPRKCAAXL
SCHEMBL13536960 0.87 PRKCQ (0.45) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9882393 0.87 PRKCQ (0.46) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9882379 0.83 PRKCQ (0.43) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9882389 0.82 PRKCQ (0.40) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9882268 0.82 PRKCQ (0.46) PRKCQPRKCDMAPTPRKCAPRKCB
SCHEMBL9883357 0.81 PRKCQ (0.52) PRKCQPRKCDPRKCAPRKCBFLT3
SCHEMBL9882018 0.81 PRKCQ (0.52) PRKCQPRKCDPRKCAPRKCBFLT3
SCHEMBL15273584 0.81 PRKCQ (0.47) PRKCQPRKCDMAPTPRKCAPRKCB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2318408-B1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMA (US) 2016-02-17 — — EP disclosed
US-9193722-B2 Tri-cyclic pyrazolopyridine kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-11-24 — — US disclosed
US-9193722-B2 Tri-cyclic pyrazolopyridine kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-11-24 — — US disclosed
US-20130252939-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-09-26 — — US disclosed
US-20130252939-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-09-26 — — US disclosed
US-20120136000-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2012-05-31 — — US disclosed
US-20120136000-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2012-05-31 — — 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-20130252939-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS MAP3K20, MAP3K5, PRKACA PRKCQ 51/4885PRKCD 144/4885MAPT 1479/4885
US-20120136000-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS MAP3K20, MAP3K5, PRKACA PRKCQ 51/4885PRKCD 144/4885MAPT 1479/4885

“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.

Send feedback