SCHEMBL9013536

SCHEMBL9013536

Nc1cnc(N)c(C(=O)c2cccc(N3CCCNCC3)n2)c1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 18/20 0.74
PRKCA P17252 3/20 0.74
PRKCD Q05655 3/20 0.74
PIM1 P11309 2/20 0.46
PIM3 Q86V86 2/20 0.46
PIM2 Q9P1W9 2/20 0.46

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
SCHEMBL8185355 0.90 PRKCQ (0.71) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL8965832 0.90 PRKCQ (0.71) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL1479328 0.90 PRKCQ (0.71) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL9011014 0.89 PRKCQ (0.68) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL9008587 0.89 PRKCQ (0.68) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL9008522 0.88 PRKCQ (0.67) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL9007436 0.88 PRKCQ (0.69) PRKCQPRKCAPRKCDPIM2
SCHEMBL8966324 0.88 PRKCQ (0.69) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL8970107 0.87 PRKCQ (0.68) PRKCQPRKCAPRKCDPIM1PIM3
SCHEMBL9012997 0.87 PRKCQ (0.68) PRKCQPRKCAPRKCDPIM1PIM3

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-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 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-20090124602-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 PRKCQ 38/4885PRKCA 25/4885PRKCD 120/4885

“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.