SCHEMBL15036041

SCHEMBL15036041

CN(C)CCn1c(=O)c(-c2ccc(S(=O)(=O)CCN(C)C)cc2F)cc2cnc(Nc3ccc(C4CCN(C)C4)cc3)nc21

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 4/20 0.46
PAK4 O96013 3/20 0.46
TNK2 Q07912 4/20 0.41
JAK3 P52333 3/20 0.41
PAK1 Q13153 4/20 0.40
SRC P12931 1/20 0.39
JAK2 O60674 3/20 0.38
BRD4 O60885 2/20 0.38
PAK3 O75914 3/20 0.38
PAK2 Q13177 3/20 0.38
LIMK1 P53667 1/20 0.38
LIMK2 P53671 1/20 0.38
WEE1 P30291 1/20 0.38
RIPK2 O43353 1/20 0.37
ACVR1 Q04771 1/20 0.37
NOD2 Q9HC29 1/20 0.37
FGFR1 P11362 1/20 0.37
PTK2 Q05397 1/20 0.36
MAP4K1 Q92918 1/20 0.36

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
SCHEMBL15041504 0.82 PKN1 (0.40) PKN1PAK4TNK2JAK3PAK1
SCHEMBL15041688 0.79 PKN1 (0.42) PKN1PAK4TNK2JAK3PAK1
SCHEMBL14681985 0.79 PKN1 (0.47) PKN1PAK4TNK2JAK3PAK1
SCHEMBL13553645 0.79 PAK4 (0.47) PKN1PAK4TNK2JAK3PAK1
SCHEMBL15035998 0.77 PAK4 (0.48) PKN1PAK4TNK2JAK3SRC
SCHEMBL15035651 0.76 PKN1 (0.40) PKN1PAK4TNK2JAK3PAK1
SCHEMBL15036134 0.76 FGFR1 (0.44) PKN1PAK4JAK3PAK1SRC
SCHEMBL15785220 0.76 PAK4 (0.51) PKN1PAK4TNK2JAK3PAK1
SCHEMBL13553908 0.74 PAK4 (0.46) PKN1PAK4TNK2JAK3PAK1
SCHEMBL15041461 0.74 PAK4 (0.42) PKN1PAK4TNK2JAK3ACVR1

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

“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.