SCHEMBL18787034

SCHEMBL18787034

CC1=NC(=O)c2ccc(Nc3ncnc4c3CCN4)cc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 5/20 0.61
▸ TNNI3K Q59H18 1/20 0.38
▸ DRD1 P21728 2/20 0.38
▸ RET P07949 2/20 0.37
▸ F9 P00740 1/20 0.37
▸ KDR P35968 2/20 0.35
▸ FLT3 P36888 2/20 0.35
▸ PLK4 O00444 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ FLT1 P17948 1/20 0.35
▸ FLT4 P35916 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ IRAK1 P51617 1/20 0.35
▸ NEK2 P51955 1/20 0.35
▸ NEK4 P51957 1/20 0.35
▸ PRKCD Q05655 1/20 0.35
▸ MAP4K2 Q12851 1/20 0.35
▸ STK3 Q13188 1/20 0.35
▸ ROCK1 Q13464 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
SCHEMBL18786656 0.82 MKNK1 (0.63) MKNK1RETKDRFLT3NTRK1
SCHEMBL18787036 0.76 MKNK1 (1.00) MKNK1TNNI3KDRD1RETF9
SCHEMBL13437229 0.71 MKNK1 (0.52) MKNK1TNNI3KRETKDRFLT1
SCHEMBL18786677 0.70 THRB (0.49) MKNK1TNNI3KCLK4MKNK2EGFR
SCHEMBL18797817 0.69 MKNK1 (0.64) MKNK1TNNI3KDRD1RETF9
SCHEMBL18786613 0.69 MKNK1 (0.55) MKNK1MKNK2EGFRERBB2
SCHEMBL12832924 0.66 MKNK1 (0.45) MKNK1DRD1RETKDRFLT3
SCHEMBL16363363 0.62 TNNI3K (0.58) MKNK1TNNI3KRETF9KDR
SCHEMBL795294 0.61 DRD1 (0.49) MKNK1DRD1RETKDRFLT1
SCHEMBL30159359 0.61 DRD1 (0.49) MKNK1DRD1RETKDRFLT1

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 3 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-10112955-B2 Isoindoline, azaisoindoline, dihydroindenone and dihydroazaindenone inhibitors of Mnk1 and Mnk2 EFFECTOR THERAPEUTICS, INC. (US) 2018-10-30 — — 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-10112955-B2 Isoindoline, azaisoindoline, dihydroindenone and dihydroazaindenone inhibitors of Mnk1 and Mnk2 NEK9, NEK2, NEK3 MKNK1 33/4885TNNI3K 25/4885DRD1 1119/4885
US-20190152988-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 NEK9, NEK2, NEK3 MKNK1 33/4885TNNI3K 25/4885DRD1 1119/4885
US-20170121346-A1 ISOINDOLINE, AZAISOINDOLINE, DIHYDROINDENONE AND DIHYDROAZAINDENONE INHIBITORS OF MNK1 AND MNK2 NEK9, NEK2, NEK3 MKNK1 33/4885TNNI3K 25/4885DRD1 1119/4885

“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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