SCHEMBL15041718

SCHEMBL15041718

O=c1c(-c2cc(S(=O)(=O)CC(F)(F)F)cs2)cc2cnc(Nc3ccc(OC4CCNC4)cc3)nc2n1CC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAK3 O75914 3/20 0.35
PAK1 Q13153 3/20 0.35
PAK2 Q13177 3/20 0.35
PKN1 Q16512 2/20 0.35
RIPK2 O43353 6/20 0.35
NOD2 Q9HC29 5/20 0.35
ACVR1 Q04771 4/20 0.35
STK4 Q13043 1/20 0.34
STK3 Q13188 1/20 0.34
SIK2 Q9H0K1 1/20 0.34
STK26 Q9P289 1/20 0.34
STK24 Q9Y6E0 1/20 0.34
FGFR1 P11362 3/20 0.34
PAK4 O96013 1/20 0.33
LIMK1 P53667 1/20 0.33
LIMK2 P53671 1/20 0.33
CDK4 P11802 3/20 0.33
CCNA2 P20248 3/20 0.33
CCND1 P24385 3/20 0.33
CDK2 P24941 3/20 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
SCHEMBL15036108 0.85 PAK1 (0.39) PAK3PAK1PAK2PKN1FGFR1
SCHEMBL15036073 0.79 CDK4 (0.43) FGFR1CDK4CCNA2CCND1CDK2
SCHEMBL15041890 0.78 TNK2 (0.40) PAK3PAK1PAK2PKN1RIPK2
SCHEMBL15036019 0.78 JAK2 (0.43) PKN1FGFR1PAK4CDK4FGFR4
SCHEMBL13553935 0.77 TNK2 (0.38) PAK3PAK1PAK2PKN1RIPK2
SCHEMBL15281043 0.74 CAMK2D (0.44) PAK3PAK1PAK2PKN1RIPK2
SCHEMBL15036149 0.73 TNK2 (0.41) PAK3PAK1PAK2PKN1RIPK2
SCHEMBL15041661 0.73 PTK2 (0.44)
SCHEMBL15041439 0.73 RIPK2 (0.42) RIPK2NOD2ACVR1FGFR1CDK4
SCHEMBL15041524 0.72 RIPK2 (0.42) PAK3PAK1PAK2PKN1RIPK2

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 3 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-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 PAK3 3/4885PAK1 6/4885PAK2 1/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 PAK3 6/4885PAK1 4/4885PAK2 2/4885

“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.