SCHEMBL9882291

SCHEMBL9882291

CC(C)CC1(CN)CCCN(c2ccc(C(F)(F)F)c(-c3n[nH]c4ncccc34)n2)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRKCQ Q04759 15/20 0.40
▸ PRKCD Q05655 8/20 0.40
▸ PIM1 P11309 3/20 0.34
▸ PRKCA P17252 8/20 0.33
▸ FLT3 P36888 2/20 0.33
▸ PRKCB P05771 1/20 0.33
▸ PRKCE Q02156 1/20 0.33
▸ GSK3B P49841 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ KCNH2 Q12809 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
SCHEMBL9882335 0.92 PRKCQ (0.42) PRKCQPRKCDPRKCAFLT3PRKCB
SCHEMBL9882394 0.90 PRKCQ (0.42) PRKCQPRKCDPRKCAFLT3PRKCB
SCHEMBL9882295 0.90 PRKCQ (0.41) PRKCQPRKCDPIM1PRKCAMAPT
SCHEMBL9882230 0.89 PRKCQ (0.41) PRKCQPRKCDPIM1PRKCAFLT3
SCHEMBL15273937 0.85 PRKCQ (0.42) PRKCQPRKCDPIM1PRKCAFLT3
SCHEMBL9882323 0.83 PRKCQ (0.40) PRKCQPRKCDPRKCAFLT3PRKCB
SCHEMBL9882261 0.83 PIM1 (0.48) PRKCQPRKCDPIM1PRKCAFLT3
SCHEMBL13537151 0.82 PRKCQ (0.41) PRKCQPRKCDPRKCAFLT3PRKCB
SCHEMBL15273563 0.81 PRKCQ (0.43) PRKCQPRKCDPIM1PRKCAFLT3
SCHEMBL9882332 0.81 PRKCQ (0.42) PRKCQPRKCDPIM1PRKCAFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 144/4885PIM1 305/4885
US-20120136000-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS MAP3K20, MAP3K5, PRKACA PRKCQ 51/4885PRKCD 144/4885PIM1 305/4885

“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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