SCHEMBL15036088

SCHEMBL15036088

CN1CCOC(c2ccc(Nc3ncc4cc(-c5cccc(S(C)(=O)=O)c5)c(=O)n(Cc5nccs5)c4n3)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 10/20 0.44
TNK2 Q07912 4/20 0.43
ACVR1 Q04771 5/20 0.42
NOD2 Q9HC29 6/20 0.41
PTK2 Q05397 2/20 0.40
WEE1 P30291 1/20 0.40
AURKA O14965 1/20 0.40
CDK4 P11802 1/20 0.40
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
SRC P12931 1/20 0.40

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
SCHEMBL15036008 0.81 TNK2 (0.42) RIPK2TNK2ACVR1NOD2WEE1
SCHEMBL15785340 0.80 PKN1 (0.45) TNK2
SCHEMBL15041856 0.79 RIPK2 (0.41) RIPK2TNK2ACVR1NOD2WEE1
SCHEMBL13553811 0.77 PKN1 (0.41) TNK2WEE1SRC
SCHEMBL15281605 0.77 PKN1 (0.53) RIPK2TNK2ACVR1NOD2WEE1
SCHEMBL15041593 0.77 JAK2 (0.39) RIPK2ACVR1NOD2PTK2WEE1
SCHEMBL15036047 0.77 TNK2 (0.40) RIPK2TNK2ACVR1NOD2WEE1
SCHEMBL14682078 0.76 RIPK2 (0.42) RIPK2TNK2ACVR1NOD2SRC
SCHEMBL15281608 0.76 PKN1 (0.47) RIPK2TNK2ACVR1NOD2WEE1
SCHEMBL15030374 0.74 WEE1 (0.70) RIPK2PTK2WEE1AURKACDK4

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-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-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-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 (1 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-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 RIPK2 971/4885TNK2 7/4885ACVR1 4752/4885

“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.