SCHEMBL15035535

SCHEMBL15035535

Cn1ccnc1-c1cc2cnc(Nc3ccc(OC4CCCNC4)cc3)nc2n(C2Cc3ccccc3S(=O)(=O)N2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 10/20 0.37
SRC P12931 1/20 0.37
CDK4 P11802 6/20 0.36
CCNA2 P20248 6/20 0.36
CCND1 P24385 6/20 0.36
CDK2 P24941 6/20 0.36
FGFR1 P11362 5/20 0.36
FGFR2 P21802 5/20 0.36
FGFR4 P22455 5/20 0.36
FGFR3 P22607 5/20 0.36
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
CCNA1 P78396 1/20 0.35
AXL P30530 3/20 0.35
CHEK1 O14757 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
SCHEMBL15035323 0.85 CDK4 (0.40) TNK2SRCCDK4CCNA2CCND1
SCHEMBL15035431 0.84 AXL (0.37) TNK2SRCCDK4CCNA2CCND1
SCHEMBL15237000 0.76 TNK2 (0.39) TNK2SRC
SCHEMBL15035300 0.74 BTK (0.40) TNK2CDK4CCNA2CCND1CDK2
SCHEMBL15035298 0.73 AXL (0.35) TNK2SRCCDK4CCNA2CCND1
SCHEMBL15034806 0.73 PRKCZ (0.38) TNK2SRCCDK4CCNA2CCND1
SCHEMBL15035748 0.73 TNK2 (0.36) TNK2SRCFGFR1FGFR4
SCHEMBL15035473 0.72 CDK4 (0.41) CDK4CCNA2CCND1CDK2FGFR1
SCHEMBL15035031 0.72 TNK2 (0.36) TNK2SRCCHEK1
SCHEMBL15035476 0.72 WEE1 (0.45) TNK2

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 7/4885SRC 26/4885CDK4 404/4885

“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.