SCHEMBL15035459

SCHEMBL15035459

Cc1scnc1-c1cc2cnc(Nc3ccc(C4CCNC4)cc3)nc2n(C2C(=O)c3ccccc3N(C)C2(C)C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 10/20 0.39
CDK6 Q00534 1/20 0.39
JAK2 O60674 3/20 0.38
BRD4 O60885 3/20 0.38
JAK1 P23458 1/20 0.38
BRD2 P25440 1/20 0.38
JAK3 P52333 1/20 0.38
BRD3 Q15059 1/20 0.38
BRDT Q58F21 1/20 0.38
CCND1 P24385 9/20 0.38
CCNA2 P20248 8/20 0.38
CDK2 P24941 8/20 0.38
FGFR1 P11362 7/20 0.38
FGFR4 P22455 7/20 0.38
FGFR2 P21802 6/20 0.38
FGFR3 P22607 6/20 0.38
BTK Q06187 1/20 0.36
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
CCNA1 P78396 1/20 0.35

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
SCHEMBL15035350 0.83 CDK4 (0.38) CDK4CDK6JAK2BRD4JAK1
SCHEMBL15035558 0.81 CDK4 (0.41) CDK4CDK6JAK2BRD4JAK1
SCHEMBL15035515 0.77 CDK4 (0.35) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL15035296 0.76 CDK4 (0.54) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL15035537 0.76 CDK4 (0.39) CDK4JAK2JAK1JAK3CCND1
SCHEMBL15035480 0.75 CDK4 (0.38) CDK4CDK6CCND1CCNA2CDK2
SCHEMBL15035740 0.74 RIPK2 (0.43) CDK4JAK2BRD4JAK1BRD2
SCHEMBL15035472 0.74 CDK4 (0.40) CDK4JAK2BRD4JAK1BRD2
SCHEMBL15034932 0.74 PAK4 (0.42) CDK4CDK6JAK2BRD4JAK1
SCHEMBL15035037 0.73 PAK4 (0.38) CDK4JAK2BRD4JAK1BRD2

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 CDK4 404/4885CDK6 435/4885JAK2 720/4885

“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.