SCHEMBL18805598

SCHEMBL18805598

CC(C)(C)OC(=O)NC1CC(=O)c2ccc(Nc3ccncn3)cc21

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 11/20 0.50
▸ MKNK2 Q9HBH9 3/20 0.49
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ BUB1 O43683 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ GPR119 Q8TDV5 1/20 0.35
▸ MPL P40238 1/20 0.35

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
SCHEMBL18786642 0.86 MKNK1 (0.53) MKNK1MKNK2LMNAGAAMPL
SCHEMBL18786803 0.75 MKNK1 (0.58) MKNK1MKNK2MPL
SCHEMBL18805599 0.75 MKNK1 (0.50) MKNK1MKNK2BUB1JAK2JAK1
SCHEMBL18805600 0.74 GAA (0.49) LMNAGAA
SCHEMBL18805603 0.72 MKNK1 (0.56) MKNK1MKNK2JAK2JAK1
SCHEMBL18819672 0.70 MKNK1 (0.48) MKNK1MKNK2BUB1JAK2JAK1
SCHEMBL28022015 0.68 CYP17A1 (0.48) JAK2JAK1GPR119
SCHEMBL30513278 0.68 CYP17A1 (0.48) JAK2JAK1GPR119
SCHEMBL31371502 0.67 GAA (0.42) LMNAGAA
SCHEMBL18786784 0.66 MKNK1 (0.69) MKNK1MKNK2MPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190152988-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 EFFECTOR THERAPEUTICS, INC. (JP) 2019-05-23 — — US disclosed
US-20170121346-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-05-04 — — US disclosed
US-20170121346-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-05-04 — — US disclosed
WO-2017075394-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 EFFECTOR THERAPEUTICS, INC. (US) 2017-05-04 — — 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 (2 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-20190152988-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 NEK9, NEK2, NEK3 MKNK1 33/4885MKNK2 23/4885LMNA 1921/4885
US-20170121346-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 NEK9, NEK2, NEK3 MKNK1 33/4885MKNK2 23/4885LMNA 1921/4885

“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.

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