SCHEMBL15041473

SCHEMBL15041473

Cn1cncc1-c1cnc(-c2cc3cnc(Nc4ccc(OC5CCNCC5)cc4)nc3n(CC3CC3)c2=O)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAK1 Q13153 6/20 0.46
STK4 Q13043 2/20 0.41
STK3 Q13188 2/20 0.41
SIK2 Q9H0K1 2/20 0.41
STK26 Q9P289 2/20 0.41
STK24 Q9Y6E0 2/20 0.41
SRC P12931 4/20 0.41
TNK2 Q07912 1/20 0.41
FGFR1 P11362 4/20 0.40
PDGFRB P09619 2/20 0.40
PDGFRA P16234 2/20 0.40
ABL1 P00519 1/20 0.40
KIT P10721 1/20 0.40
MAPK14 Q16539 1/20 0.40
RIPK2 O43353 5/20 0.40
ACVR1 Q04771 5/20 0.40
NOD2 Q9HC29 5/20 0.40
EGFR P00533 2/20 0.40
PKN1 Q16512 2/20 0.38
PAK4 O96013 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
SCHEMBL13553886 0.91 PAK1 (0.44) PAK1STK4STK3SIK2STK26
SCHEMBL15785376 0.81 PKN1 (0.44) PAK1STK4STK3SIK2STK26
SCHEMBL15787827 0.79 PKN1 (0.43) PAK1STK4STK3SIK2STK26
SCHEMBL15041238 0.76 PAK1 (0.39) PAK1SRCTNK2FGFR1PAK2
SCHEMBL13553621 0.75 TNK2 (0.40) PAK1SRCTNK2
SCHEMBL13553760 0.74 PAK1 (0.44) PAK1STK4STK3SIK2STK26
SCHEMBL16309202 0.74 PAK1 (0.45) PAK1STK4STK3SIK2STK26
SCHEMBL13553662 0.73 PKN1 (0.47) PAK1STK4STK3SIK2STK26
SCHEMBL13553723 0.73 TNK2 (0.42) PAK1SRCTNK2PKN1PAK4
SCHEMBL15785275 0.71 PAK1 (0.42) PAK1STK4STK3SIK2STK26

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-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 PAK1 4/4885STK4 272/4885STK3 333/4885

“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.