SCHEMBL3327285

SCHEMBL3327285

CNCCNc1nc(-c2ccncc2)cc2cnccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKCH P24723 14/20 1.00
PRKCD Q05655 13/20 1.00
PRKCE Q02156 13/20 1.00
PRKCQ Q04759 10/20 1.00
PRKCA P17252 8/20 0.74
PRKCB P05771 4/20 0.74
PRKD1 Q15139 3/20 0.74
ROCK2 O75116 2/20 0.74
ROCK1 Q13464 2/20 0.74
PKN1 Q16512 2/20 0.74
PKN2 Q16513 2/20 0.74
CYP1A2 P05177 1/20 0.65
LATS1 O95835 3/20 0.51
LATS2 Q9NRM7 2/20 0.51

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
SCHEMBL3326372 0.86 PRKCH (0.75) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL3327608 0.85 PRKCH (1.00) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL3325947 0.84 PRKCD (0.73) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL3325495 0.83 PRKCD (1.00) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL3325548 0.82 PRKCD (0.76) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL17197936 0.79 PRKCD (0.67) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL13337102 0.79 PRKCD (1.00) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL13336981 0.79 PRKCH (1.00) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL18391620 0.79 PRKCD (1.00) PRKCHPRKCDPRKCEPRKCQPRKCA
SCHEMBL3325753 0.78 PRKCD (0.69) PRKCHPRKCDPRKCEPRKCQPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130469-A1 2, 6-NAPHTHRIDINE DERIVATIVES VAN EIS MAURICE 2010-05-27 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-20100130469-A1 2, 6-NAPHTHRIDINE DERIVATIVES PKN1, PKN2, CDK9 PRKCH 22/4885PRKCD 63/4885PRKCE 18/4885

“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.