SCHEMBL1045873

SCHEMBL1045873

COCCN1CCC(c2ccc(Nc3nc(-c4cccc(OC)n4)cc4cc[nH]c(=O)c34)cc2C)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 13/20 0.62
TGFBR1 P36897 2/20 0.39
TLR9 Q9NR96 1/20 0.38
BRD4 O60885 1/20 0.37
ATAD2 Q6PL18 1/20 0.37
FER P16591 1/20 0.37
ALK Q9UM73 1/20 0.36
IGF1R P08069 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL1048329 0.91 ZAP70 (0.75) ZAP70BRD4ATAD2IGF1RCYP3A4
SCHEMBL1048611 0.91 ZAP70 (0.67) ZAP70TGFBR1FER
SCHEMBL1049379 0.90 ZAP70 (0.59) ZAP70TLR9IGF1RCYP3A4
SCHEMBL6525135 0.88 ZAP70 (0.74) ZAP70BRD4ATAD2FER
SCHEMBL1049107 0.87 ZAP70 (0.63) ZAP70FER
SCHEMBL1159759 0.86 ZAP70 (0.64) ZAP70BRD4ATAD2
SCHEMBL1158486 0.85 ZAP70 (0.61) ZAP70BRD4ATAD2
SCHEMBL6522850 0.85 ZAP70 (0.72) ZAP70
SCHEMBL1048447 0.85 ZAP70 (0.68) ZAP70TLR9BRD4ATAD2
SCHEMBL1048278 0.85 ZAP70 (0.56) ZAP70BRD4ATAD2FERALK

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
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
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
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET ZAP70 4/4885TGFBR1 2576/4885TLR9 457/4885

“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.