SCHEMBL15775548

SCHEMBL15775548

COC(=O)c1cn(CCN)cn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GRM2 Q14416 1/20 0.40
CPB2 Q96IY4 9/20 0.39
CPB1 P15086 5/20 0.39
SMYD3 Q9H7B4 1/20 0.38
ADAMTS5 Q9UNA0 2/20 0.37
MAPK1 P28482 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
KCNH2 Q12809 1/20 0.36
SYK P43405 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
SCHEMBL2282033 0.85 CPB2 (0.45) MEN1KMT2AGRM2CPB2CPB1
SCHEMBL20857112 0.84 NOTUM (0.47) MEN1KMT2ACPB2CPB1
SCHEMBL21361934 0.84 MEN1 (0.43) MEN1KMT2AGRM2CPB2SMYD3
SCHEMBL26813648 0.83 CPB2 (0.42) MEN1KMT2AGRM2CPB2CPB1
SCHEMBL26813651 0.83 CPB2 (0.45) MEN1KMT2AGRM2CPB2CPB1
SCHEMBL20139133 0.83 MEN1 (0.42) MEN1KMT2AGRM2CPB2SMYD3
SCHEMBL7425205 0.81 SMYD3 (0.50) MEN1KMT2AGRM2CPB2SMYD3
SCHEMBL5726708 0.81 CPB2 (0.45) MEN1KMT2AGRM2CPB2CPB1
SCHEMBL28579686 0.81 MEN1 (0.41) MEN1KMT2AGRM2CPB2CPB1
SCHEMBL26641301 0.81 KDM5A (0.47) MEN1KMT2AGRM2SMYD3ADAMTS5

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-20150299143-A1 SUBSTITUTED TRIAZOLE AND IMIDAZOLE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2015-10-22 US disclosed
EP-2925746-A1 SUBSTITUTED TRIAZOLE AND IMIDAZOLE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2015-10-07 EP disclosed
WO-2014086663-A1 SUBSTITUTED TRIAZOLE AND IMIDAZOLE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-06-12 WO 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-20150299143-A1 SUBSTITUTED TRIAZOLE AND IMIDAZOLE COMPOUNDS HDAC7, PSMB7, IKZF3 MEN1 2978/4885KMT2A 875/4885GRM2 4114/4885

“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.