SCHEMBL15041260

SCHEMBL15041260

O=c1c(-c2cnc(-c3cnsc3)nc2)cc2cnc(Nc3ccc(OC4CCNC4)cc3)nc2n1CCN1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 2/20 0.39
ACVR1 Q04771 2/20 0.39
NOD2 Q9HC29 2/20 0.39
JAK2 O60674 1/20 0.39
TBK1 Q9UHD2 1/20 0.39
TNK2 Q07912 6/20 0.38
JAK3 P52333 1/20 0.37
WEE1 P30291 2/20 0.37
FGFR1 P11362 4/20 0.37
SRC P12931 2/20 0.37
PDGFRB P09619 1/20 0.37
SLC2A1 P11166 1/20 0.37
PDGFRA P16234 1/20 0.37
PKMYT1 Q99640 1/20 0.37
FGFR4 P22455 2/20 0.36
KDR P35968 1/20 0.36
PAK4 O96013 1/20 0.36
PKN1 Q16512 1/20 0.36
CDK4 P11802 1/20 0.36
CCNA2 P20248 1/20 0.36

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
SCHEMBL13553656 0.88 RIPK2 (0.38) RIPK2ACVR1NOD2JAK2TBK1
SCHEMBL15785229 0.79 TNK2 (0.39) TNK2WEE1FGFR1SRCPDGFRB
SCHEMBL15036016 0.78 TNK2 (0.40) TNK2WEE1SRCPAK4PKN1
SCHEMBL15041896 0.78 TNK2 (0.39) TNK2WEE1SRCPAK4PKN1
SCHEMBL15041238 0.77 PAK1 (0.39) TNK2FGFR1SRCFGFR4CDK4
SCHEMBL14682000 0.74 RIPK2 (0.42) RIPK2ACVR1NOD2TNK2WEE1
SCHEMBL15036132 0.71 TNK2 (0.41) TNK2SRCCDK4CCND1CCND2
SCHEMBL14681991 0.71 PRKCZ (0.40) RIPK2ACVR1NOD2TNK2FGFR1
SCHEMBL13553731 0.71 JAK3 (0.42) TNK2JAK3WEE1FGFR1SRC
SCHEMBL15035102 0.71 TNK2 (0.42) TNK2SRCPAK4PKN1

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 RIPK2 971/4885ACVR1 4752/4885NOD2 4628/4885

“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.