SCHEMBL1045355

SCHEMBL1045355

CS(=O)(=O)c1cncc(-c2cc3cc[nH]c(=O)c3c(Nc3ccc(-c4cccnc4)cc3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 15/20 0.51
PIP4K2A P48426 3/20 0.41
PIP4K2C Q8TBX8 1/20 0.41
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
PIP4K2B P78356 2/20 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
SCHEMBL1047847 0.84 ZAP70 (0.49) ZAP70PIP4K2ABRD4CREBBPPIP4K2B
SCHEMBL1045387 0.83 ZAP70 (0.59) ZAP70BRD4CREBBP
SCHEMBL1049149 0.80 ZAP70 (0.77) ZAP70BRD4CREBBP
SCHEMBL1044233 0.80 ZAP70 (0.77) ZAP70BRD4CREBBP
SCHEMBL1048587 0.79 ZAP70 (0.57) ZAP70
SCHEMBL1048678 0.79 KMT2A (0.48) ZAP70
SCHEMBL1049464 0.79 ZAP70 (0.49) ZAP70
SCHEMBL1045395 0.78 ZAP70 (0.64) ZAP70
SCHEMBL15290705 0.77 ZAP70 (0.42) ZAP70
SCHEMBL3358578 0.76 PIP4K2A (0.40) PIP4K2APIP4K2CBRD4CREBBP

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 4/4885PIP4K2A 307/4885PIP4K2C 213/4885

“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.