SCHEMBL15035745

SCHEMBL15035745

Cc1ccc(-c2cc3cnc(Nc4ccc(OC5CCN(C)CC5)cc4)nc3n(Cc3cccc(S(=O)(=O)c4nccs4)c3)c2=O)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 4/20 0.48
NOD2 Q9HC29 4/20 0.48
ACVR1 Q04771 2/20 0.48
PKN1 Q16512 3/20 0.45
PAK1 Q13153 3/20 0.45
PAK4 O96013 2/20 0.45
TNK2 Q07912 8/20 0.44
PAK3 O75914 2/20 0.44
PAK2 Q13177 2/20 0.44
SRC P12931 1/20 0.44
WEE1 P30291 1/20 0.43
FGFR1 P11362 1/20 0.42
AXL P30530 2/20 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
SCHEMBL15035665 0.79 PKN1 (0.45) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL15237029 0.77 PKN1 (0.47) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL15034797 0.77 PKN1 (0.46) RIPK2NOD2PKN1PAK1PAK4
SCHEMBL15277155 0.76 PKN1 (0.56) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL15034906 0.76 PKN1 (0.49) PKN1PAK1PAK4TNK2PAK3
SCHEMBL15035795 0.75 PKN1 (0.55) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL14682078 0.74 RIPK2 (0.42) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL15041593 0.73 JAK2 (0.39) RIPK2NOD2ACVR1PKN1PAK4
SCHEMBL15035427 0.72 AXL (0.46) RIPK2NOD2ACVR1PKN1PAK1
SCHEMBL15035311 0.72 AXL (0.47) RIPK2NOD2ACVR1PKN1PAK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252967-A1 8-(SULFONYLBENZYL)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-20130252967-A1 8-(SULFONYLBENZYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK3, PAK6 RIPK2 1162/4885NOD2 4034/4885ACVR1 4860/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 RIPK2 971/4885NOD2 4628/4885ACVR1 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.