SCHEMBL15035866

SCHEMBL15035866

CN1CCC(c2ccc(Nc3ncc4cc(N(C)c5ccccc5)c(=O)n(Cc5ccoc5S(=O)(=O)c5nccs5)c4n3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 5/20 0.40
BRD4 O60885 3/20 0.40
MAP4K1 Q92918 8/20 0.39
PAK4 O96013 1/20 0.39
PKN1 Q16512 1/20 0.39
WEE1 P30291 1/20 0.38
JAK3 P52333 5/20 0.38
PTK2 Q05397 3/20 0.38
TNK2 Q07912 1/20 0.37
KCNH2 Q12809 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
SCHEMBL15034882 0.82 PAK4 (0.42) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15277152 0.78 FGFR4 (0.45) JAK2BRD4PAK4PKN1WEE1
SCHEMBL15035736 0.78 JAK3 (0.39) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15035650 0.77 PAK4 (0.42) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15041347 0.77 JAK3 (0.36) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15034827 0.77 JAK3 (0.38) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15035783 0.76 FGFR4 (0.43) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15277138 0.76 JAK2 (0.41) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15035897 0.75 JAK2 (0.40) JAK2BRD4MAP4K1PAK4PKN1
SCHEMBL15041414 0.75 JAK2 (0.39) JAK2BRD4MAP4K1PAK4PKN1

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-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-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
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 JAK2 227/4885BRD4 711/4885MAP4K1 22/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 JAK2 720/4885BRD4 1003/4885MAP4K1 84/4885

“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.