SCHEMBL1038017

SCHEMBL1038017

CN1CCN(CCCOc2ccc(Nc3ncc(Cl)c(Nc4ccccc4NS(C)(=O)=O)n3)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.66
ALK Q9UM73 7/20 0.64
FLT3 P36888 2/20 0.64
AXL P30530 3/20 0.61
MERTK Q12866 1/20 0.61
ROS1 P08922 4/20 0.59
AURKA O14965 1/20 0.57
AURKB Q96GD4 1/20 0.57
MAP3K7 O43318 1/20 0.56
MET P08581 1/20 0.53

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
SCHEMBL12726512 0.91 ALK (0.63) EGFRALKFLT3AXLROS1
SCHEMBL1039635 0.90 GLO1 (0.66) EGFRALKFLT3AXLMERTK
SCHEMBL1039506 0.86 GLO1 (0.67) EGFRALKFLT3AXLMERTK
SCHEMBL12726508 0.85 ALK (0.62) EGFRALKFLT3AXLMERTK
SCHEMBL12726436 0.84 GLO1 (0.67) EGFRALKFLT3AXLMERTK
SCHEMBL12726435 0.83 GLO1 (0.66) EGFRALKFLT3AXLMERTK
SCHEMBL1039004 0.81 ALK (0.56) EGFRALKFLT3AXLMERTK
SCHEMBL1038670 0.81 AXL (0.63) EGFRALKFLT3AXLMERTK
SCHEMBL12726513 0.81 MAPK9 (0.67) EGFRALKROS1MET
SCHEMBL29833000 0.81 EGFR (0.74) EGFRALKAXLMERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098288-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2011-04-28 US claimed
EP-2276747-A1 SULFONAMIDES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2011-01-26 EP claimed
WO-2009112490-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2009-09-17 WO claimed
US-20110098288-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2011-04-28 US disclosed
US-20110098288-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2011-04-28 US disclosed
US-20110098288-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2011-04-28 US disclosed
EP-2276747-A1 SULFONAMIDES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2011-01-26 EP disclosed
WO-2009112490-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2009-09-17 WO disclosed
WO-2009112490-A1 SULFONAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2009-09-17 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-20110098288-A1 SULFONAMIDES AS ZAP-70 INHIBITORS ZAP70, SYK, LCK EGFR 2061/4885ALK 846/4885FLT3 147/4885

“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.