SCHEMBL138685

SCHEMBL138685

O=C(O)N(CC1CCOCC1)c1cc(Cl)nn2cnnc12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 3/20 0.31
KAT7 O95251 2/20 0.31
KAT5 Q92993 2/20 0.31
KAT8 Q9H7Z6 2/20 0.31
SYK P43405 1/20 0.31
MALT1 Q9UDY8 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
SCHEMBL104916 0.85 CNR1 (0.31) KAT6AKAT7KAT5KAT8
SCHEMBL140375 0.84 HPGD (0.34) KAT6AKAT7KAT5KAT8MALT1
SCHEMBL140752 0.83 TTK (0.36)
SCHEMBL135511 0.79 MALT1 (0.36) KAT6AKAT7KAT5KAT8SYK
SCHEMBL104406 0.72 TTK (0.33)
SCHEMBL104784 0.71 GPR119 (0.33) KAT6AKAT7KAT5KAT8
SCHEMBL105076 0.70 TTK (0.34) KAT7
SCHEMBL140248 0.69 TTK (0.56)
SCHEMBL139126 0.67 TTK (0.41)
SCHEMBL10282607 0.67 TTK (0.33)

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
EP-2460805-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION Oncotherapy Science, Inc. (JP) 2012-06-06 EP disclosed
US-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION ONCOTHERAPY SCIENCE, INC. (JP) 2012-03-08 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-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION NR0B1, GRK7, NR5A2 KAT6A 2397/4885KAT7 593/4885KAT5 1344/4885

“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.