SCHEMBL21554444

SCHEMBL21554444

Fc1ccc2c(ncn2-c2nc(OCCc3ccccn3)ncc2Cl)c1F

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 12/20 0.68
MKNK2 Q9HBH9 10/20 0.68
KRAS P01116 2/20 0.36
RPS6KA5 O75582 1/20 0.34
PDE10A Q9Y233 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TYK2 P29597 1/20 0.32
SYK P43405 1/20 0.32
BRSK1 Q8TDC3 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32

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
SCHEMBL21554504 0.90 MKNK1 (0.66) MKNK1MKNK2KRASRPS6KA5PDE10A
SCHEMBL21554403 0.81 MKNK1 (0.74) MKNK1MKNK2
SCHEMBL22722391 0.81 MKNK1 (1.00) MKNK1MKNK2KRASALDH1A1TYK2
SCHEMBL21554502 0.79 MKNK1 (0.88) MKNK1MKNK2PDE10A
SCHEMBL22722372 0.72 MKNK1 (0.77) MKNK1MKNK2
SCHEMBL21554500 0.71 MKNK1 (0.68) MKNK1MKNK2
SCHEMBL21554435 0.70 MKNK1 (0.51) MKNK1MKNK2PDE10AALDH1A1TYK2
SCHEMBL22722381 0.69 MKNK1 (1.00) MKNK1MKNK2
SCHEMBL22722377 0.68 MKNK1 (0.72) MKNK1MKNK2
SCHEMBL20479141 0.67 MKNK1 (1.00) MKNK1MKNK2RPS6KA5

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-10851082-B2 Substituted aromatic n-heterocyclic compounds as inhibitors of mitogen-activated protein kinase interacting kinase 1 (MNK1) and 2 (MNK2) NORTHWESTERN UNIVERSITY (US) 2020-12-01 US disclosed
EP-3564235-A1 SUBSTITUTED AROMATIC N-HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE INTERACTING KINASE 1 (MNK1) AND 2 (MNK2) Northwestern University (US) 2019-11-06 EP 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-10851082-B2 Substituted aromatic n-heterocyclic compounds as inhibitors of mitogen-activated protein kinase interacting kinase 1 (MNK1) and 2 (MNK2) MAP4K2, MAP3K20, MKNK2 MKNK1 5/4885MKNK2 3/4885KRAS 275/4885

“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.