SCHEMBL15041755

SCHEMBL15041755

CN(c1ccc(Nc2ncc3cc(C(=O)C4CC4)c(=O)n(Cc4ccn(C)c4-c4nccs4)c3n2)cc1)C1CCCNC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 12/20 0.36
CCND1 P24385 10/20 0.36
FGFR1 P11362 7/20 0.36
CCNA2 P20248 7/20 0.36
FGFR2 P21802 7/20 0.36
FGFR4 P22455 7/20 0.36
FGFR3 P22607 7/20 0.36
CDK2 P24941 7/20 0.36
PTK2 Q05397 1/20 0.33
BRAF P15056 1/20 0.32
JAK3 P52333 2/20 0.32
SYK P43405 1/20 0.32
CCND3 P30281 3/20 0.32
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
CCND2 P30279 2/20 0.31
CCNA1 P78396 1/20 0.31
CHEK1 O14757 2/20 0.31
FLT3 P36888 2/20 0.31

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
SCHEMBL15034943 0.94 CDK4 (0.36) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15242117 0.79 CDK4 (0.37) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041404 0.77 CDK4 (0.38) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041645 0.77 CDK4 (0.36) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041750 0.77 PTK2 (0.39) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL13553922 0.76 CDK4 (0.39) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041828 0.76 CDK4 (0.36) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041648 0.74 CDK4 (0.35) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15041573 0.74 CDK4 (0.42) CDK4CCND1FGFR1CCNA2FGFR2
SCHEMBL15036232 0.73 CDK4 (0.36) CDK4CCND1FGFR1CCNA2FGFR2

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 CDK4 404/4885CCND1 2153/4885FGFR1 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.