SCHEMBL15035700

SCHEMBL15035700

CCOc1cc2cnc(Nc3ccc(NC4CCN(C)CC4)cc3)nc2n(Cc2cccn2S(C)(=O)=O)c1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 6/20 0.41
TNK2 Q07912 1/20 0.41
JAK2 O60674 4/20 0.39
BRD4 O60885 4/20 0.39
FGFR4 P22455 2/20 0.39
MAPK8 P45983 1/20 0.39
FGFR1 P11362 2/20 0.39
CDK4 P11802 3/20 0.39
CCND1 P24385 3/20 0.39
JAK3 P52333 2/20 0.39
MAPK14 Q16539 1/20 0.39
PTK2 Q05397 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR3 P22607 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CDK6 Q00534 1/20 0.39
CCND2 P30279 1/20 0.38
CCND3 P30281 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
SCHEMBL15034837 0.82 CDK4 (0.41) WEE1TNK2BRD4FGFR4MAPK8
SCHEMBL15035052 0.80 TNK2 (0.41) WEE1TNK2FGFR4MAPK8FGFR1
SCHEMBL15035910 0.78 PAK1 (0.38) WEE1TNK2JAK2BRD4FGFR4
SCHEMBL15034945 0.78 TNK2 (0.39) WEE1TNK2FGFR4MAPK8FGFR1
SCHEMBL15035842 0.76 PAK4 (0.44) WEE1TNK2JAK2BRD4FGFR4
SCHEMBL15035822 0.76 CDK4 (0.40) WEE1TNK2FGFR4MAPK8FGFR1
SCHEMBL15035364 0.75 CDK4 (0.46) WEE1TNK2FGFR4MAPK8FGFR1
SCHEMBL15035675 0.74 CCND1 (0.35) WEE1JAK2BRD4FGFR4FGFR1
SCHEMBL15035465 0.73 CDK4 (0.44) TNK2BRD4FGFR4FGFR1CDK4
SCHEMBL15035934 0.73 JAK3 (0.42) WEE1TNK2JAK2BRD4FGFR4

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 4 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-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
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 WEE1 983/4885TNK2 28/4885JAK2 227/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 WEE1 545/4885TNK2 7/4885JAK2 720/4885

“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.