SCHEMBL15041495

SCHEMBL15041495

Cc1scnc1C#Cc1cc2cnc(Nc3ccc(C4CN(C)CCS4)cc3)nc2n(Cc2ncoc2N2CCOCC2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.37
CCND1 P24385 4/20 0.37
CCND2 P30279 3/20 0.37
CCND3 P30281 3/20 0.37
PDGFRB P09619 2/20 0.37
FGFR1 P11362 2/20 0.37
SLC2A1 P11166 1/20 0.37
SRC P12931 1/20 0.37
PDGFRA P16234 1/20 0.37
PKMYT1 Q99640 1/20 0.37
CDK1 P06493 2/20 0.35
CCNB1 P14635 2/20 0.35
PIK3CD O00329 1/20 0.35
PRKAB2 O43741 1/20 0.35
NUAK1 O60285 1/20 0.35
CCNT1 O60563 1/20 0.35
ABL1 P00519 1/20 0.35
FYN P06241 1/20 0.35
CSF1R P07333 1/20 0.35
RET P07949 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
SCHEMBL15617497 0.90 CDK4 (0.37) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15036464 0.89 CDK4 (0.36) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15041735 0.81 CDK4 (0.39) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15258300 0.79 CDK4 (0.36) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15258244 0.77 CDK2 (0.37) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15036323 0.76 WEE1 (0.38) CDK4CCND1PDGFRBFGFR1SRC
SCHEMBL15237008 0.75 PKN1 (0.40) PDGFRBFGFR1SLC2A1SRCPDGFRA
SCHEMBL15041733 0.74 TNK2 (0.36) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15041496 0.74 PAK4 (0.34) CDK4CCND1CCND2CCND3PDGFRB
SCHEMBL15036267 0.74 TNK2 (0.37) CDK4CCND1CCND2CCND3PDGFRB

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 2153/4885CCND2 2332/4885

“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.