SCHEMBL1049360

SCHEMBL1049360

CC(=O)N1CCC(c2ccc(Nc3nc(-c4ccc(C)nc4)cc4cc[nH]c(=O)c34)cc2C)CC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 14/20 0.65
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
SYK P43405 2/20 0.39
KDR P35968 1/20 0.39
KCNH2 Q12809 1/20 0.39
FER P16591 1/20 0.37
MAP3K12 Q12852 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
SCHEMBL1044965 0.92 ZAP70 (0.67) ZAP70FERMAP3K12
SCHEMBL1045704 0.90 ZAP70 (0.68) ZAP70SYK
SCHEMBL1080971 0.90 ZAP70 (0.62) ZAP70SYKKDRKCNH2FER
SCHEMBL1048484 0.90 ZAP70 (0.64) ZAP70SYKKDRKCNH2FER
SCHEMBL1048203 0.90 ZAP70 (0.80) ZAP70SYKFER
SCHEMBL1048539 0.90 ZAP70 (0.70) ZAP70BRD4CREBBPSYK
SCHEMBL1048181 0.89 ZAP70 (0.81) ZAP70SYKFER
SCHEMBL1158399 0.85 ZAP70 (0.61) ZAP70SYK
SCHEMBL1158486 0.85 ZAP70 (0.61) ZAP70BRD4SYK
SCHEMBL12929635 0.84 ZAP70 (0.59) ZAP70FER

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-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
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 4/4885BRD4 2595/4885CREBBP 713/4885

“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.