SCHEMBL140375

SCHEMBL140375

O=C(O)N(CC1CCOCC1)c1cc(Cl)nn2ccnc12

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.33
APOBEC3A P31941 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
CSF1R P07333 1/20 0.32
KAT7 O95251 5/20 0.32
KAT5 Q92993 5/20 0.32
KAT6A Q92794 3/20 0.32
KAT8 Q9H7Z6 2/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MAPK14 Q16539 1/20 0.31
BRD4 O60885 1/20 0.30
RAF1 P04049 1/20 0.30
BRAF P15056 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
SCHEMBL104784 0.86 GPR119 (0.33) HPGDSMN1; SMN2KAT7KAT5KAT6A
SCHEMBL138685 0.84 KAT6A (0.31) MALT1KAT7KAT5KAT6AKAT8
SCHEMBL139126 0.82 TTK (0.41) CSF1R
SCHEMBL139379 0.80 MAPK14 (0.37) CSF1RPIK3R1PIK3CAMTORMAPK14
SCHEMBL135511 0.80 MALT1 (0.36) MALT1KAT7KAT5KAT6AKAT8
SCHEMBL138064 0.78 OPRM1 (0.33)
SCHEMBL12986677 0.76 L3MBTL1 (0.41) CSF1RPIK3R1PIK3CAL3MBTL1MAPK14
SCHEMBL140248 0.73 TTK (0.56)
SCHEMBL104841 0.73 TTK (0.38) CSF1RRAF1BRAF
SCHEMBL105318 0.72 TTK (0.37)

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 HPGD 4110/4885SMN1; SMN2 4581/4885ALDH1A1 3128/4885

“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.