SCHEMBL15035853

SCHEMBL15035853

Cc1scnc1-c1cc2cnc(Nc3ccc(C4CN(C)CCS4)cc3)nc2n(Cc2ccsc2S(=O)(=O)c2nccs2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 1/20 0.38
PAK1 Q13153 3/20 0.37
PKN1 Q16512 3/20 0.37
PAK3 O75914 2/20 0.37
PAK2 Q13177 2/20 0.37
PAK4 O96013 2/20 0.36
FGFR1 P11362 3/20 0.36
TNK2 Q07912 7/20 0.36
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CCND2 P30279 1/20 0.34
CCND3 P30281 1/20 0.34

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
SCHEMBL15035769 0.80 WEE1 (0.39) WEE1PAK1PKN1PAK3PAK2
SCHEMBL15237008 0.79 PKN1 (0.40) WEE1PAK1PKN1PAK3PAK2
SCHEMBL15034998 0.76 PKN1 (0.38) WEE1PAK1PKN1PAK3PAK2
SCHEMBL15035715 0.76 FGFR1 (0.34) WEE1PAK1PKN1PAK3PAK2
SCHEMBL16309178 0.74 TNK2 (0.43) WEE1PAK1PKN1PAK3PAK2
SCHEMBL15035494 0.74 WEE1 (0.37) WEE1FGFR1TNK2EGFRSRC
SCHEMBL15035387 0.73 CDK4 (0.37) WEE1FGFR1TNK2EGFRSRC
SCHEMBL15785369 0.72 PKN1 (0.43) WEE1PAK1PKN1PAK3PAK2
SCHEMBL14681996 0.71 TNK2 (0.43) WEE1PKN1PAK4TNK2SRC
SCHEMBL15034863 0.70 PKN1 (0.38) WEE1PAK1PKN1PAK3PAK2

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 WEE1 983/4885PAK1 6/4885PKN1 430/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 WEE1 545/4885PAK1 4/4885PKN1 326/4885

“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.