SCHEMBL15041441

SCHEMBL15041441

Cc1c(-c2cc3cnc(Nc4ccc(C5CCCN(C)C5)cc4)nc3n(Cc3ccccc3C(F)(F)F)c2=O)ncn1-c1cscn1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 4/20 0.46
TNK2 Q07912 9/20 0.43
WEE1 P30291 1/20 0.40
PAK4 O96013 1/20 0.38
PKN1 Q16512 1/20 0.38
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
MAP4K1 Q92918 2/20 0.36
MAP4K3 Q8IVH8 1/20 0.36
JAK2 O60674 1/20 0.36
BRD4 O60885 1/20 0.36

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
SCHEMBL13553653 0.90 PTK2 (0.47) PTK2TNK2WEE1PAK4PKN1
SCHEMBL15785231 0.82 TNK2 (0.46) PTK2TNK2WEE1PAK4PKN1
SCHEMBL13553667 0.81 PTK2 (0.47) PTK2TNK2WEE1PAK4PKN1
SCHEMBL15036015 0.81 PTK2 (0.48) PTK2TNK2WEE1PAK4PKN1
SCHEMBL15785302 0.76 TNK2 (0.51) PTK2TNK2PAK4PKN1
SCHEMBL16309177 0.73 PTK2 (0.43) PTK2TNK2WEE1PAK4PKN1
SCHEMBL13553800 0.72 PTK2 (0.46) PTK2TNK2WEE1PAK4PKN1
SCHEMBL15035062 0.72 MAP4K1 (0.48) PTK2TNK2WEE1PAK4PKN1
SCHEMBL15041550 0.72 PTK2 (0.51) PTK2TNK2WEE1FLT4KDR
SCHEMBL15281134 0.72 WEE1 (0.49) PTK2TNK2WEE1PAK4PKN1

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 PTK2 12/4885TNK2 7/4885WEE1 545/4885

“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.