SCHEMBL15041791

SCHEMBL15041791

Cc1sc(-c2cccnc2)nc1-c1cc2cnc(Nc3ccc(N(C)C4CCNCC4)cc3)nc2n(Cc2nccs2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 6/20 0.37
PAK1 Q13153 3/20 0.36
ACVR1 Q04771 3/20 0.35
RIPK2 O43353 2/20 0.35
NOD2 Q9HC29 2/20 0.35
EGFR P00533 1/20 0.35
FGFR1 P11362 1/20 0.35
PLAT P00750 1/20 0.35
STK4 Q13043 1/20 0.34
STK3 Q13188 1/20 0.34
SIK2 Q9H0K1 1/20 0.34
STK26 Q9P289 1/20 0.34
STK24 Q9Y6E0 1/20 0.34
PAK3 O75914 2/20 0.34
PAK2 Q13177 2/20 0.34
PKN1 Q16512 1/20 0.34

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
SCHEMBL14682099 0.95 TNK2 (0.40) TNK2ACVR1RIPK2NOD2EGFR
SCHEMBL13553876 0.89 TNK2 (0.42) TNK2ACVR1RIPK2NOD2EGFR
SCHEMBL15788013 0.81 TNK2 (0.42) TNK2PAK1PAK3PAK2PKN1
SCHEMBL15041879 0.79 RIPK2 (0.37) TNK2PAK1ACVR1RIPK2NOD2
SCHEMBL13553922 0.77 CDK4 (0.39) TNK2PAK1ACVR1RIPK2NOD2
SCHEMBL14693031 0.76 ACVR1 (0.40) TNK2PAK1ACVR1RIPK2NOD2
SCHEMBL13553829 0.73 RIPK2 (0.47) ACVR1RIPK2NOD2EGFRFGFR1
SCHEMBL15787985 0.72 TYRO3 (0.42) TNK2FGFR1STK4STK3SIK2
SCHEMBL15041195 0.72 CDK4 (0.39) TNK2FGFR1
SCHEMBL15035049 0.72 CDK4 (0.35) TNK2FGFR1

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 TNK2 7/4885PAK1 4/4885ACVR1 4752/4885

“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.