SCHEMBL15035702

SCHEMBL15035702

C=C(c1cc2cnc(Nc3ccc(OC4CCCN(C)C4)cc3)nc2n(Cc2ccoc2S(=O)(=O)CCOC)c1=O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 8/20 0.38
INSR P06213 1/20 0.36
AXL P30530 1/20 0.36
KDR P35968 1/20 0.36
CAMK2D Q13557 1/20 0.36
TNK2 Q07912 8/20 0.35
SRC P12931 1/20 0.35
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33
EGFR P00533 1/20 0.33
ITK Q08881 1/20 0.33

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
SCHEMBL15041825 0.94 JAK3 (0.38) JAK3INSRAXLKDRCAMK2D
SCHEMBL15035816 0.80 CAMK2D (0.35) JAK3INSRAXLKDRCAMK2D
SCHEMBL15035638 0.79 CAMK2D (0.39) JAK3INSRAXLCAMK2DCDK4
SCHEMBL15034834 0.78 CDK4 (0.36) JAK3INSRAXLKDRCAMK2D
SCHEMBL15035908 0.78 CAMK2D (0.35) JAK3INSRAXLKDRCAMK2D
SCHEMBL15034938 0.78 CAMK2D (0.36) JAK3INSRAXLKDRCAMK2D
SCHEMBL15035044 0.77 CDK4 (0.38) JAK3INSRAXLKDRCAMK2D
SCHEMBL15035774 0.77 PLK2 (0.39) JAK3INSRAXLCAMK2DCDK4
SCHEMBL15034770 0.76 CAMK2D (0.40) JAK3AXLCAMK2DTNK2SRC
SCHEMBL15035782 0.74 PTK2 (0.38) JAK3TNK2SRC

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-20130252967-A1 8-(SULFONYLBENZYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 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-20130252967-A1 8-(SULFONYLBENZYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK3, PAK6 JAK3 525/4885INSR 3671/4885AXL 935/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 JAK3 1901/4885INSR 3942/4885AXL 1075/4885

“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.