SCHEMBL10182056

SCHEMBL10182056

O=Cc1cccc(-c2cnn(-c3cncnc3)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 12/20 0.36
GRM5 P41594 1/20 0.36
GRM2 Q14416 1/20 0.32
GRM4 Q14833 2/20 0.32
MKNK2 Q9HBH9 2/20 0.32
P2RX7 Q99572 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
MELK Q14680 1/20 0.32
TYK2 P29597 1/20 0.30

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
SCHEMBL12410583 0.87 MKNK1 (0.40) MKNK1GRM5GRM4MKNK2
SCHEMBL10182240 0.84 GRM4 (0.36) MKNK1GRM5GRM2GRM4MKNK2
SCHEMBL12410434 0.77 GRM5 (0.44) MKNK1GRM5GRM4MKNK2
SCHEMBL10233625 0.76 IRAK4 (0.46) GRM2IRAK4TYK2
SCHEMBL3394370 0.76 MKNK1 (0.35) MKNK1GRM5GRM2GRM4MKNK2
SCHEMBL12410578 0.76 GABRA1 (0.39) MKNK1GRM5IRAK4
SCHEMBL21791746 0.72 PIM1 (0.36) GRM2IRAK4
SCHEMBL12410500 0.71 MKNK1 (0.35) MKNK1GRM5GRM4MKNK2IRAK4
SCHEMBL10182229 0.70 IRAK4 (0.43) IRAK4MELK
SCHEMBL10182009 0.69 IRAK4 (0.42) MKNK1IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165345-A1 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2012-06-28 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 (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-20120165345-A1 Heterocyclic compounds as pesticides DDT, ACHE, PTMS MKNK1 1426/4885GRM5 1306/4885GRM2 724/4885

“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.