SCHEMBL15034871

SCHEMBL15034871

CC(C)C(=O)c1cc2cnc(Nc3ccc(OC4CCN(C)C4)cc3)nc2n(Cc2ccccc2C2CCNC2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 1/20 0.41
CCNA2 P20248 5/20 0.38
CDK2 P24941 5/20 0.38
CDK4 P11802 4/20 0.38
CCND1 P24385 4/20 0.38
FGFR1 P11362 3/20 0.38
FGFR2 P21802 3/20 0.38
FGFR4 P22455 3/20 0.38
FGFR3 P22607 3/20 0.38
JAK3 P52333 8/20 0.38
FLT4 P35916 1/20 0.35
AXL P30530 1/20 0.35
EGFR P00533 1/20 0.35
MAP4K1 Q92918 1/20 0.35
RIPK2 O43353 1/20 0.35
ACVR1 Q04771 1/20 0.35
NOD2 Q9HC29 1/20 0.35
CCNA1 P78396 1/20 0.35
PTK2 Q05397 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
SCHEMBL15041761 0.93 CAMK2D (0.41) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041402 0.84 CDK4 (0.38) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041355 0.82 CAMK2D (0.41) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041432 0.81 CDK4 (0.39) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041427 0.81 CAMK2D (0.41) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041181 0.79 CAMK2D (0.41) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041193 0.78 CAMK2D (0.41) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15034834 0.78 CDK4 (0.36) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15280131 0.77 CAMK2D (0.40) CAMK2DCCNA2CDK2CDK4CCND1
SCHEMBL15041409 0.76 CAMK2D (0.37) CAMK2DCCNA2CDK2CDK4CCND1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231348-A1 8-(HETEROARYLMETHYL)PYRIDO[2,3-d]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-05 US disclosed
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 (2 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-20130231348-A1 8-(HETEROARYLMETHYL)PYRIDO[2,3-d]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK3, PAK5 CAMK2D 125/4885CCNA2 2279/4885CDK2 104/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 CAMK2D 469/4885CCNA2 2011/4885CDK2 183/4885

“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.