SCHEMBL1048294

SCHEMBL1048294

COCCN1CCC(c2ccc(Nc3nc(-c4cnc(N)c(C)c4)cc4cc[nH]c(=O)c34)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 15/20 0.62
MAP3K12 Q12852 2/20 0.40
BRD4 O60885 1/20 0.40
ATAD2 Q6PL18 1/20 0.40
IGF1R P08069 1/20 0.40
CYP3A4 P08684 1/20 0.40
SYK P43405 1/20 0.37

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
SCHEMBL1045554 0.90 ZAP70 (0.65) ZAP70BRD4ATAD2IGF1RCYP3A4
SCHEMBL1047735 0.86 ZAP70 (0.79) ZAP70IGF1RCYP3A4SYK
SCHEMBL1045501 0.85 ZAP70 (0.51) ZAP70MAP3K12BRD4ATAD2IGF1R
SCHEMBL1049792 0.85 ZAP70 (0.57) ZAP70BRD4ATAD2IGF1RCYP3A4
SCHEMBL1048396 0.84 ZAP70 (0.58) ZAP70SYK
SCHEMBL3359221 0.83 ZAP70 (0.58) ZAP70SYK
SCHEMBL1159759 0.82 ZAP70 (0.64) ZAP70BRD4ATAD2SYK
SCHEMBL12795288 0.82 ZAP70 (0.58) ZAP70SYK
SCHEMBL1158486 0.82 ZAP70 (0.61) ZAP70BRD4ATAD2SYK
SCHEMBL1158281 0.82 ZAP70 (0.58) ZAP70SYK

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 7 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-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
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 4/4885MAP3K12 157/4885BRD4 2595/4885

“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.