SCHEMBL14684796

SCHEMBL14684796

CCn1c(=O)c(-c2ccc(-c3ccc(NC(C)=O)nc3)cc2CI)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAK1 Q13153 3/20 0.60
▸ PKN1 Q16512 3/20 0.60
▸ PAK4 O96013 2/20 0.60
▸ PAK3 O75914 2/20 0.58
▸ PAK2 Q13177 2/20 0.58
▸ WEE1 P30291 1/20 0.57
▸ CDK4 P11802 5/20 0.51
▸ CCND1 P24385 5/20 0.51
▸ CCND2 P30279 5/20 0.51
▸ CCND3 P30281 5/20 0.51
▸ FLT3 P36888 1/20 0.46
▸ FGFR1 P11362 1/20 0.46
▸ SRC P12931 1/20 0.46
▸ FGFR2 P21802 1/20 0.46
▸ FGFR4 P22455 1/20 0.46
▸ FGFR3 P22607 1/20 0.46
▸ JAK2 O60674 3/20 0.44
▸ BTK Q06187 2/20 0.44
▸ MAPK8 P45983 1/20 0.43
▸ JAK3 P52333 3/20 0.43

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
SCHEMBL13553581 0.90 PAK1 (0.72) PAK1PKN1PAK4PAK3PAK2
SCHEMBL15035083 0.90 WEE1 (0.63) PAK1PKN1PAK4PAK3PAK2
SCHEMBL14684869 0.85 PAK1 (0.66) PAK1PKN1PAK4PAK3PAK2
SCHEMBL14684813 0.83 PAK1 (0.62) PAK1PKN1PAK4PAK3PAK2
SCHEMBL14824762 0.79 PAK1 (0.65) PAK1PKN1PAK4PAK3PAK2
SCHEMBL15030453 0.79 PAK1 (0.79) PAK1PKN1PAK4PAK3PAK2
SCHEMBL15030332 0.79 PAK1 (0.73) PAK1PKN1PAK4PAK3PAK2
SCHEMBL13554057 0.78 PAK1 (0.76) PAK1PKN1PAK4PAK3PAK2
SCHEMBL15030203 0.77 PAK1 (0.67) PAK1PKN1PAK4PAK3PAK2
SCHEMBL13553595 0.77 PAK1 (0.81) PAK1PKN1PAK4PAK3PAK2

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-20130035335-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-02-07 — — 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-20130035335-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK5 PAK1 5/4885PKN1 528/4885PAK4 6/4885

“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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