SCHEMBL17101346

SCHEMBL17101346

COCCS(=O)(=O)N1CCC(c2c[nH]c3c(C(=O)O)cc(-c4ccc5c(c4)CN(C(C)C)C5)cc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 19/20 0.53
CHUK O15111 6/20 0.53
BTK Q06187 2/20 0.53
AURKA O14965 1/20 0.53
FLT3 P36888 1/20 0.53
CSNK1E P49674 1/20 0.53
TYRO3 Q06418 1/20 0.36
CSF1R P07333 1/20 0.33

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
SCHEMBL1686986 0.93 IKBKB (0.60) IKBKBCHUKBTKAURKAFLT3
SCHEMBL552458 0.84 IKBKB (0.70) IKBKBCHUKBTKAURKAFLT3
SCHEMBL10050273 0.81 IKBKB (0.60) IKBKBCHUKBTKAURKAFLT3
SCHEMBL551959 0.80 IKBKB (0.68) IKBKBCHUKBTKAURKAFLT3
SCHEMBL3803112 0.79 IKBKB (0.82) IKBKBCHUKBTKAURKAFLT3
SCHEMBL553113 0.79 IKBKB (0.68) IKBKBCHUKBTKAURKAFLT3
SCHEMBL553393 0.78 IKBKB (0.69) IKBKBCHUKBTKAURKAFLT3
SCHEMBL553388 0.75 IKBKB (0.73) IKBKBCHUKBTKAURKAFLT3
SCHEMBL552321 0.75 IKBKB (0.72) IKBKBCHUKBTKAURKAFLT3
SCHEMBL3796669 0.74 IKBKB (0.67) IKBKBCHUKBTKAURKAFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954211-B2 Chemical compounds ASTRAZENECA AB (SE) 2021-03-23 US disclosed
CN-106103423-B Pyrazine compounds 阿斯利康(瑞典)有限公司 2019-12-06 CN disclosed
US-20190330187-A1 Chemical Compounds ASTRAZENECA UK LIMITED (GB) 2019-10-31 US disclosed
US-10336725-B2 Chemical compounds ASTRAZENECA AB (SE) 2019-07-02 US disclosed
US-20180162838-A1 Chemical Compounds ASTRAZENECA AB (SE) 2018-06-14 US disclosed
EP-3119752-B1 3,4-DIAMINO-6-CHLOROPYRAZINE-2-CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF ENAC MEDIATED DISEASES ASTRAZENECA AB (SE) 2018-05-16 EP disclosed
US-9873678-B2 Chemical compounds ASTRAZENECA AB (SE) 2018-01-23 US disclosed
US-20170107195-A1 Chemical Compounds ASTRAZENECA AB (SE) 2017-04-20 US disclosed
EP-3119752-A1 CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2017-01-25 EP disclosed
WO-2015140527-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2015-09-24 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 (5 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-20170107195-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A IKBKB 1053/4885CHUK 1034/4885BTK 2318/4885
US-10336725-B2 Chemical compounds CFTR, SCNN1B, SCNN1A IKBKB 1053/4885CHUK 1034/4885BTK 2318/4885
US-20180162838-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A IKBKB 1053/4885CHUK 1034/4885BTK 2318/4885
US-10954211-B2 Chemical compounds CFTR, SCNN1B, SCNN1A IKBKB 1053/4885CHUK 1034/4885BTK 2318/4885
US-20190330187-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A IKBKB 1053/4885CHUK 1034/4885BTK 2318/4885

“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.