SCHEMBL15041891

SCHEMBL15041891

CCn1c(=O)c(-c2ccc(S(=O)(=O)c3ccccc3)cc2Cl)cc2cnc(Nc3ccc(C4CN(C)CCO4)cc3)nc21

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 5/20 0.56
PAK4 O96013 4/20 0.56
PAK1 Q13153 5/20 0.55
EGFR P00533 2/20 0.51
FGFR1 P11362 2/20 0.51
WEE1 P30291 1/20 0.50
PAK2 Q13177 4/20 0.49
PAK3 O75914 3/20 0.49
LIMK1 P53667 1/20 0.46
LIMK2 P53671 1/20 0.46
TNK2 Q07912 6/20 0.46
RIPK2 O43353 2/20 0.43
NOD2 Q9HC29 2/20 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
SCHEMBL13554017 0.87 PKN1 (0.60) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13553532 0.87 PKN1 (0.66) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL15281605 0.86 PKN1 (0.53) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13554115 0.85 PKN1 (0.67) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13554114 0.85 PKN1 (0.61) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13554110 0.84 PKN1 (0.62) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13554038 0.84 PKN1 (0.63) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL14681964 0.83 PAK1 (0.62) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13554120 0.82 PKN1 (0.61) PKN1PAK4PAK1EGFRFGFR1
SCHEMBL13553561 0.82 PKN1 (0.61) PKN1PAK4PAK1EGFRFGFR1

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-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 US disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 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-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 PKN1 326/4885PAK4 5/4885PAK1 4/4885

“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.