SCHEMBL15035576

SCHEMBL15035576

Cc1ccccc1-c1cc2cnc(Nc3ccc(N4CCNCC4)c(C)c3)nc2n(C2Cc3ccccc3C(=O)N2C)c1=O

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 14/20 0.56
KCNH2 Q12809 1/20 0.47
FGFR1 P11362 1/20 0.46
CDK4 P11802 1/20 0.46
CCNA2 P20248 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
FGFR3 P22607 1/20 0.46
CCND1 P24385 1/20 0.46
CDK2 P24941 1/20 0.46
PAK3 O75914 1/20 0.46
PAK4 O96013 1/20 0.46
LIMK1 P53667 1/20 0.46
LIMK2 P53671 1/20 0.46
PAK1 Q13153 1/20 0.46
PAK2 Q13177 1/20 0.46
PKN1 Q16512 1/20 0.46
WEE1 P30291 2/20 0.46
EGFR P00533 1/20 0.46

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
SCHEMBL15035477 0.87 TNK2 (0.55) TNK2KCNH2FGFR1CDK4CCNA2
SCHEMBL15035370 0.80 TNK2 (0.52) TNK2KCNH2FGFR1CDK4CCNA2
SCHEMBL15041805 0.79 CDK4 (0.57) FGFR1CDK4CCNA2FGFR2FGFR4
SCHEMBL15035351 0.79 CDK2 (0.45) TNK2FGFR1CDK4CCNA2FGFR2
SCHEMBL15035380 0.78 CDK4 (0.55) FGFR1CDK4CCNA2FGFR2FGFR4
SCHEMBL15035413 0.78 CDK4 (0.58) FGFR1CDK4CCNA2FGFR2FGFR4
SCHEMBL15035548 0.76 RIPK2 (0.43) TNK2FGFR1FGFR2FGFR4FGFR3
SCHEMBL15034848 0.76 TNK2 (0.60) TNK2PAK3PAK4LIMK1LIMK2
SCHEMBL29785351 0.75 TNK2 (0.66) TNK2EGFR
SCHEMBL20674137 0.75 TNK2 (0.66) TNK2EGFR

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-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 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 TNK2 7/4885KCNH2 4768/4885FGFR1 1919/4885

“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.