SCHEMBL14201627

SCHEMBL14201627

N#Cc1nn(COCCO)c2ncnc(N)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 1/20 0.41
PIK3CD O00329 8/20 0.40
SRC P12931 8/20 0.40
MTOR P42345 7/20 0.40
KDR P35968 7/20 0.40
ABL1 P00519 6/20 0.40
EGFR P00533 6/20 0.40
HCK P08631 6/20 0.40
PIK3CA P42336 6/20 0.40
PIK3CB P42338 6/20 0.40
PIK3CG P48736 6/20 0.40
EPHB4 P54760 6/20 0.40
PRKDC P78527 6/20 0.40
PI4KB Q9UBF8 3/20 0.38
LRRK2 Q5S007 2/20 0.37
RPS6KA3 P51812 1/20 0.37
LCK P06239 1/20 0.36
TEK Q02763 1/20 0.36
DYRK1A Q13627 1/20 0.36
CDK5 Q00535 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
SCHEMBL4010074 0.82 ATG7 (0.52) ATG7PIK3CDSRCMTORKDR
SCHEMBL1848609 0.75 ATG7 (0.43) ATG7PIK3CDSRCMTORKDR
SCHEMBL8442195 0.75 SRC (0.43) PIK3CDSRCMTORKDRABL1
SCHEMBL1847885 0.71 ATG7 (0.43) ATG7PIK3CDSRCKDRABL1
SCHEMBL2880679 0.68 BTK (0.58) PIK3CDSRCMTORKDRABL1
SCHEMBL8444992 0.68 SRC (0.46) SRCKDRABL1EGFRLCK
SCHEMBL8441851 0.68 DYRK3 (0.54) SRCMTORLCKTEKDYRK1A
SCHEMBL8442394 0.68 SRC (0.46) SRCLCKTEKDYRK1A
SCHEMBL3779239 0.66 SRC (0.55) PIK3CDSRCMTORKDRABL1
SCHEMBL3829445 0.66 ADK (0.44) ATG7PIK3CDSRCMTORKDR

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-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 US disclosed
US-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 US disclosed
WO-2008049105-A2 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 WO 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 (1 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-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF HSP90AB2P, HSP90AB1, HSP90AA1 ATG7 1635/4885PIK3CD 1789/4885SRC 131/4885

“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.