SCHEMBL15041504

SCHEMBL15041504

CN(C)CCn1c(=O)c(-c2ccc(S(=O)(=O)C3CC3)cc2F)cc2cnc(Nc3ccc(C4CN(C)CCS4)cc3)nc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 4/20 0.40
PAK1 Q13153 4/20 0.40
PAK4 O96013 3/20 0.40
TNK2 Q07912 4/20 0.39
WEE1 P30291 1/20 0.39
SRC P12931 1/20 0.39
PAK3 O75914 3/20 0.38
PAK2 Q13177 3/20 0.38
LIMK1 P53667 1/20 0.38
LIMK2 P53671 1/20 0.38
FGFR1 P11362 2/20 0.36
JAK3 P52333 2/20 0.36
RIPK2 O43353 4/20 0.36
NOD2 Q9HC29 4/20 0.36
ACVR1 Q04771 3/20 0.36
JAK2 O60674 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL15041668 0.84 CDK4 (0.37) PKN1PAK4TNK2SRCFGFR1
SCHEMBL15036041 0.82 PKN1 (0.46) PKN1PAK1PAK4TNK2WEE1
SCHEMBL16309192 0.82 TNK2 (0.46) PKN1PAK1PAK4TNK2WEE1
SCHEMBL15036098 0.81 TNK2 (0.47) PKN1PAK1PAK4TNK2WEE1
SCHEMBL14681985 0.76 PKN1 (0.47) PKN1PAK1PAK4TNK2WEE1
SCHEMBL14681942 0.76 BTK (0.39) PKN1PAK4TNK2SRCJAK3
SCHEMBL13553645 0.75 PAK4 (0.47) PKN1PAK1PAK4TNK2SRC
SCHEMBL15041858 0.75 TNK2 (0.41) PKN1PAK4TNK2SRCFGFR1
SCHEMBL16309178 0.74 TNK2 (0.43) PKN1PAK1PAK4TNK2WEE1
SCHEMBL13554015 0.73 PAK1 (0.59) PKN1PAK1PAK4TNK2WEE1

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 PKN1 534/4885PAK1 6/4885PAK4 5/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 PKN1 326/4885PAK1 4/4885PAK4 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.