SCHEMBL15041871

SCHEMBL15041871

CCn1c(=O)c(-c2c(Cl)cccc2S(C)(=O)=O)cc2cnc(Nc3ccc(N4CCNCC4)cc3)nc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 2/20 0.71
FGFR1 P11362 8/20 0.62
EGFR P00533 2/20 0.62
PAK1 Q13153 4/20 0.57
PKN1 Q16512 3/20 0.57
PAK4 O96013 2/20 0.57
SRC P12931 3/20 0.57
FGFR2 P21802 2/20 0.57
FGFR4 P22455 2/20 0.57
FGFR3 P22607 2/20 0.57
PDGFRB P09619 2/20 0.56
PDGFRA P16234 2/20 0.56
SLC2A1 P11166 1/20 0.56
PKMYT1 Q99640 1/20 0.56
PAK3 O75914 3/20 0.55
PAK2 Q13177 3/20 0.55
LIMK1 P53667 1/20 0.55
LIMK2 P53671 1/20 0.55
RIPK2 O43353 5/20 0.53
NOD2 Q9HC29 5/20 0.53

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
SCHEMBL15281619 0.92 WEE1 (0.85) WEE1FGFR1EGFRPAK1PKN1
SCHEMBL15030466 0.82 WEE1 (0.73) WEE1FGFR1EGFRPAK1PKN1
SCHEMBL24534196 0.82 SRC (0.83) WEE1FGFR1EGFRSRCFGFR2
SCHEMBL15030375 0.80 WEE1 (0.71) WEE1FGFR1PAK1PKN1PAK4
SCHEMBL15035155 0.80 PAK1 (0.68) WEE1FGFR1EGFRPAK1PKN1
SCHEMBL2251720 0.80 FGFR1 (0.66) WEE1FGFR1EGFRSRCFGFR2
SCHEMBL14824792 0.79 PAK1 (0.66) WEE1FGFR1EGFRPAK1PKN1
SCHEMBL16309191 0.78 JAK2 (0.49) WEE1FGFR1PAK1PKN1PAK4
SCHEMBL14824790 0.78 PAK1 (0.68) WEE1FGFR1EGFRPAK1PKN1
SCHEMBL15030467 0.78 PAK1 (0.81) WEE1FGFR1EGFRPAK1PKN1

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 WEE1 545/4885FGFR1 1919/4885EGFR 737/4885

“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.