SCHEMBL15036098

SCHEMBL15036098

CN1CCC(S(=O)(=O)c2ccc(-c3cc4cnc(Nc5ccc(C6CN(C)CCS6)cc5)nc4n(CC4CC4)c3=O)c(C(F)(F)F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 12/20 0.47
PKN1 Q16512 3/20 0.41
PAK4 O96013 2/20 0.41
PAK1 Q13153 3/20 0.39
PAK3 O75914 2/20 0.38
PAK2 Q13177 2/20 0.38
CNR2 P34972 1/20 0.38
WEE1 P30291 1/20 0.38
JAK3 P52333 1/20 0.38
PTK2 Q05397 1/20 0.37

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
SCHEMBL16309192 0.91 TNK2 (0.46) TNK2PKN1PAK4PAK1WEE1
SCHEMBL15036057 0.82 TNK2 (0.47) TNK2PKN1PAK4PAK1WEE1
SCHEMBL15041504 0.81 PKN1 (0.40) TNK2PKN1PAK4PAK1PAK3
SCHEMBL15041507 0.81 TNK2 (0.44) TNK2PKN1PAK4PAK1PAK3
SCHEMBL15036026 0.81 TNK2 (0.44) TNK2PKN1PAK4PAK1PAK3
SCHEMBL15041669 0.76 PTK2 (0.43) TNK2PTK2
SCHEMBL15041668 0.76 CDK4 (0.37) TNK2PKN1PAK4
SCHEMBL15035995 0.76 TNK2 (0.42) TNK2PKN1PAK4PAK1PAK3
SCHEMBL14682005 0.75 TNK2 (0.48) TNK2PKN1PAK4PAK1PTK2
SCHEMBL13553839 0.75 PAK1 (0.42) TNK2PKN1PAK4PAK1PAK3

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 14/4885PKN1 534/4885PAK4 5/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 TNK2 7/4885PKN1 326/4885PAK4 5/4885

“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.