SCHEMBL15035246

SCHEMBL15035246

CC1(C)Oc2ccccc2C(=O)C1n1c(=O)c(-c2ccccc2Cl)cc2cnc(Nc3ccc(C4=CCNCC4)cc3)nc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.43
CDK6 Q00534 2/20 0.43
RIPK2 O43353 2/20 0.40
ACVR1 Q04771 2/20 0.40
NOD2 Q9HC29 2/20 0.40
TNK2 Q07912 4/20 0.40
MAPK14 Q16539 6/20 0.39
LCK P06239 1/20 0.39
FGFR1 P11362 7/20 0.39
SRC P12931 7/20 0.39
EGFR P00533 4/20 0.39
WEE1 P30291 3/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
PDGFRB P09619 6/20 0.38
PDGFRA P16234 6/20 0.38
ABL1 P00519 5/20 0.38
SLC2A1 P11166 1/20 0.38
PKMYT1 Q99640 1/20 0.38

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
SCHEMBL15035484 0.90 CDK4 (0.43) CDK4CDK6FGFR1FGFR2FGFR4
SCHEMBL15041298 0.88 CDK4 (0.43) CDK4CDK6TNK2FGFR1SRC
SCHEMBL15035251 0.87 CDK4 (0.43) CDK4CDK6RIPK2ACVR1NOD2
SCHEMBL15035272 0.82 FGFR1 (0.57) CDK4CDK6TNK2FGFR1SRC
SCHEMBL15035258 0.82 PAK3 (0.57) CDK4CDK6TNK2SRCWEE1
SCHEMBL15035249 0.81 CDK4 (0.41) CDK4CDK6RIPK2ACVR1NOD2
SCHEMBL15035341 0.80 RIPK2 (0.41) CDK4CDK6RIPK2NOD2TNK2
SCHEMBL15035255 0.79 PAK1 (0.42) RIPK2NOD2TNK2
SCHEMBL15035250 0.78 TNK2 (0.43) CDK4CDK6RIPK2ACVR1NOD2
SCHEMBL15035257 0.78 CDK4 (0.42) CDK4CDK6RIPK2ACVR1NOD2

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 3 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
WO-2011156775-A2 8-(2'-HETEROCYCYL)PYRIDO[2.3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2011-12-15 WO 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 435/4885RIPK2 971/4885

“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.