SCHEMBL6522580

SCHEMBL6522580

O=c1[nH]ccc2cc(Cl)nc(Nc3ccc(C4CCC(N5CCOCC5)CC4)cc3)c12

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 15/20 0.53
ABL1 P00519 1/20 0.42
LCK P06239 1/20 0.42
LYN P07948 1/20 0.42
MET P08581 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
SRC P12931 1/20 0.42
FGFR3 P22607 1/20 0.42
AXL P30530 1/20 0.42
KDR P35968 1/20 0.42
FLT3 P36888 1/20 0.42
JAK3 P52333 1/20 0.42
TEK Q02763 1/20 0.42
KARS1 Q15046 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.40
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 0.40
SYK P43405 1/20 0.39

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
SCHEMBL6522583 1.00 ZAP70 (0.53) ZAP70ABL1LCKLYNMET
SCHEMBL6525176 0.86 ZAP70 (0.73) ZAP70SYK
SCHEMBL12794986 0.86 ZAP70 (0.73) ZAP70SYK
SCHEMBL1160013 0.86 ZAP70 (0.73) ZAP70SYK
SCHEMBL12794991 0.83 ZAP70 (0.62) ZAP70ABL1LCKLYNMET
SCHEMBL12794978 0.83 ZAP70 (0.62) ZAP70ABL1LCKLYNMET
SCHEMBL1158509 0.83 ZAP70 (0.62) ZAP70ABL1LCKLYNMET
SCHEMBL12795280 0.83 ZAP70 (0.61) ZAP70SYK
SCHEMBL1158783 0.83 ZAP70 (0.61) ZAP70SYK
SCHEMBL1049032 0.81 ZAP70 (0.72) ZAP70JAK2SYK

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-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 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 (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-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS SYK, BTK, LYN ZAP70 5/4885ABL1 20/4885LCK 4/4885

“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.