SCHEMBL3330215

SCHEMBL3330215

CC(N)C(N)c1nc(-c2cccnc2)cc2cnccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCH P24723 6/20 0.45
PRKCE Q02156 6/20 0.45
PRKCD Q05655 6/20 0.45
PRKCQ Q04759 5/20 0.45
PRKCA P17252 4/20 0.45
PRKCB P05771 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP19A1 P11511 1/20 0.43
CYP2A6 P11509 4/20 0.39
HTT P42858 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
USP2 O75604 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
PTK2 Q05397 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL3325764 0.88 PRKCD (0.57) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL29634278 0.88 PRKCD (0.57) PRKCHPRKCEPRKCDPRKCQPRKCA
Ammonia Solution, Strong SCHEMBL19611956 0.78 PRKCD (0.56) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL11368186 0.76 CYP19A1 (0.51) CYP1A2CYP19A1CYP2A6HSP90AA1HSP90AB1
SCHEMBL3327832 0.75 PRKCD (0.55) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL3325696 0.72 PRKCD (0.52) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL3325907 0.71 PRKCH (0.60) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL3325795 0.70 PRKCD (0.50) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL15544680 0.69 PRKCH (0.55) PRKCHPRKCEPRKCDPRKCQPRKCA
SCHEMBL3322844 0.69 PRKCD (0.54) PRKCHPRKCEPRKCDPRKCQPRKCA

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 22/4885PRKCE 18/4885PRKCD 63/4885

“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.