SCHEMBL15035284

SCHEMBL15035284

C=C1C=Cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2N1C1CSc2ccccc2C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 5/20 0.51
AURKA O14965 1/20 0.51
ALK Q9UM73 3/20 0.47
EGFR P00533 5/20 0.46
PKN1 Q16512 2/20 0.45
JAK2 O60674 1/20 0.45
ERBB2 P04626 1/20 0.45
MET P08581 1/20 0.45
KIT P10721 1/20 0.45
SRC P12931 1/20 0.45
PRKCA P17252 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
KDR P35968 1/20 0.45
MAPK9 P45984 1/20 0.45
JAK3 P52333 1/20 0.45
PRKCQ Q04759 1/20 0.45
KARS1 Q15046 1/20 0.45
ERBB4 Q15303 1/20 0.45
MAPK14 Q16539 1/20 0.45

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
SCHEMBL15035264 0.86 CDK4 (0.51) CDK4AURKAALKEGFRPKN1
SCHEMBL15035278 0.85 CDK4 (0.50) CDK4AURKAALKEGFRPKN1
SCHEMBL15035271 0.85 CDK4 (0.50) CDK4AURKAALKEGFRPKN1
SCHEMBL15035466 0.81 CDK4 (0.43) CDK4EGFRJAK2JAK1JAK3
SCHEMBL15041538 0.78 CDK4 (0.71) CDK4AURKAALKEGFRPKN1
SCHEMBL10192607 0.75 ALK (0.49) CDK4ALKEGFRCDK2BRD4
SCHEMBL15035280 0.73 TNK2 (0.52) CDK4AURKAALKEGFRPKN1
SCHEMBL15035263 0.73 TNK2 (0.48) CDK4AURKAALKEGFRPKN1
SCHEMBL15035282 0.71 FGFR1 (0.58) CDK4AURKAPKN1SRCCCND3
SCHEMBL15035268 0.69 PAK1 (0.55) CDK4AURKAEGFRPKN1SRC

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 404/4885AURKA 653/4885ALK 2737/4885

“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.