SCHEMBL15036057

SCHEMBL15036057

CC(C)S(=O)(=O)c1ccc(-c2cc3cnc(Nc4ccc(C5CCN(C)C5)cc4)nc3n(CC3CC3)c2=O)c(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 10/20 0.47
PAK4 O96013 2/20 0.45
PKN1 Q16512 2/20 0.45
PTK2 Q05397 4/20 0.41
JAK3 P52333 1/20 0.40
PAK1 Q13153 1/20 0.40
JAK2 O60674 1/20 0.39
BRD4 O60885 1/20 0.39
WEE1 P30291 1/20 0.39
CDK1 P06493 1/20 0.38
CDK2 P24941 1/20 0.38
KDR P35968 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
SCHEMBL16309182 0.90 PAK4 (0.48) TNK2PAK4PKN1JAK3PAK1
SCHEMBL15036098 0.82 TNK2 (0.47) TNK2PAK4PKN1PTK2JAK3
SCHEMBL15036135 0.80 WEE1 (0.43) TNK2PAK4PKN1PTK2JAK2
SCHEMBL14682005 0.80 TNK2 (0.48) TNK2PAK4PKN1PTK2PAK1
SCHEMBL13553678 0.77 TNK2 (0.48) TNK2PAK4PKN1PTK2PAK1
SCHEMBL15035103 0.77 TNK2 (0.47) TNK2PAK4PKN1PAK1WEE1
SCHEMBL15785331 0.77 TNK2 (0.46) TNK2PAK4PKN1PTK2PAK1
SCHEMBL15036149 0.75 TNK2 (0.41) TNK2PAK4PKN1PAK1BRD4
SCHEMBL15041688 0.75 PKN1 (0.42) TNK2PAK4PKN1PTK2JAK3
SCHEMBL15036155 0.75 JAK2 (0.48) TNK2PAK4PKN1JAK3PAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 US disclosed
US-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 US disclosed
US-20130252966-A1 6-(SULFONYLARYL)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-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK3 TNK2 14/4885PAK4 5/4885PKN1 534/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 TNK2 7/4885PAK4 5/4885PKN1 326/4885

“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.