SCHEMBL1047358

SCHEMBL1047358

COc1ccc(-c2c[nH]c(=O)c3c(Nc4ccc(N5CCOCC5)cc4)nccc23)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 8/20 0.49
KDR P35968 3/20 0.46
ABL1 P00519 1/20 0.46
NTRK1 P04629 1/20 0.46
YES1 P07947 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ITK Q08881 2/20 0.42
PKMYT1 Q99640 1/20 0.42
CLK1 P49759 1/20 0.41
DYRK1A Q13627 1/20 0.41
SRC P12931 1/20 0.41
FGFR4 P22455 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL12929094 0.90 ZAP70 (0.52) ZAP70MAPTKMT2ASMN1; SMN2ITK
SCHEMBL1046783 0.88 KDR (0.54) ZAP70KDRABL1NTRK1YES1
SCHEMBL1049198 0.87 ZAP70 (0.49) ZAP70MAPTTSHRCNR2BRAF
SCHEMBL1049116 0.85 CLK1 (0.58) ZAP70KDRABL1NTRK1YES1
SCHEMBL1048699 0.83 ZAP70 (0.54) ZAP70MAPTMAPK1SMN1; SMN2ITK
SCHEMBL1043465 0.82 ZAP70 (0.62) ZAP70POLBMAPTTSHRMAPK1
SCHEMBL1048404 0.80 ZAP70 (0.51) ZAP70PKMYT1SRCCNR2FGFR1
SCHEMBL1049307 0.80 ZAP70 (0.56) ZAP70KDRABL1NTRK1YES1
SCHEMBL1049469 0.79 ZAP70 (0.59) ZAP70KDRABL1NTRK1YES1
SCHEMBL1047617 0.78 ZAP70 (0.54) ZAP70KDRMAPTSMN1; SMN2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US claimed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET ZAP70 4/4885KDR 18/4885ABL1 11/4885

“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.