SCHEMBL18805637

SCHEMBL18805637

COc1ccc(CN2C(=O)c3c(Cl)cc(NC(=O)OC(C)(C)C)cc3C23CCCCC3)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 4/20 0.37
▸ TP53 P04637 1/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ MMP8 P22894 2/20 0.36
▸ MMP3 P08254 1/20 0.36
▸ GRIN1 Q05586 1/20 0.35
▸ GRIN2A Q12879 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ OPRL1 P41146 1/20 0.35
▸ ITGB1 P05556 1/20 0.35
▸ ITGA4 P13612 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ AKR1B1 P15121 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 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
SCHEMBL18805633 0.91 LMNA (0.38) MKNK2LMNAMAPTTP53KCNH2
SCHEMBL18805632 0.91 LMNA (0.38) MKNK2LMNAMAPTTP53MMP8
SCHEMBL18786874 0.88 LMNA (0.41) LMNAMAPTTP53RAB9AKCNH2
SCHEMBL18805631 0.84 OPRM1 (0.35) MKNK2LMNAMAPTTP53RAB9A
SCHEMBL18786598 0.79 LMNA (0.41) LMNAMAPTTP53PKMAKR1B1
SCHEMBL18786698 0.79 CTSK (0.41) LMNAMAPTTP53PKMAKR1B1
SCHEMBL18789167 0.79 PARK7 (0.41) LMNAMAPTKCNH2GRIN1GRIN2A
SCHEMBL18789165 0.77 PARK7 (0.42) LMNAMAPTKCNH2GRIN1GRIN2A
SCHEMBL18786900 0.77 TUBB4A (0.46) MKNK2LMNATP53RAB9AMEN1
SCHEMBL18786603 0.77 MKNK1 (0.40) MKNK2LMNAOPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20170121346-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 NEK9, NEK2, NEK3 MKNK2 23/4885LMNA 1921/4885MAPT 1447/4885

“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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