SCHEMBL407351

SCHEMBL407351

COC(=O)C1CCC(c2nnc(C(C)(C)C)o2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.37
DPP4 P27487 3/20 0.37
DPP8 Q6V1X1 2/20 0.37
DPP7 Q9UHL4 1/20 0.37
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ADCY1 Q08828 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TNKS O95271 1/20 0.34
PARP1 P09874 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
EPHX2 P34913 2/20 0.33
PDK1 Q15118 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADCY8 P40145 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL441292 1.00 PDK2 (0.37) PDK2DPP4DPP8DPP7PKM
SCHEMBL31503269 0.92 DPP4 (0.35) PDK2DPP4DPP8DPP7PKM
SCHEMBL31503455 0.92 DPP4 (0.35) PDK2DPP4DPP8DPP7PKM
SCHEMBL408407 0.86 PKM (0.41) PKMSMN1; SMN2ADCY1MEN1KMT2A
SCHEMBL442998 0.86 PKM (0.41) PKMSMN1; SMN2ADCY1MEN1KMT2A
SCHEMBL443032 0.84 PDK2 (0.39) PDK2DPP4DPP8DPP7SMN1; SMN2
SCHEMBL408397 0.84 PDK2 (0.39) PDK2DPP4DPP8DPP7SMN1; SMN2
SCHEMBL12783412 0.81 PDK2 (0.38) PDK2MEN1KMT2ATNKSPARP1
SCHEMBL408403 0.81 PKM (0.39) PKMSMN1; SMN2ADCY1MEN1KMT2A
SCHEMBL441026 0.81 PKM (0.39) PKMSMN1; SMN2ADCY1MEN1KMT2A

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-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT PDK2 263/4885DPP4 725/4885DPP8 750/4885

“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.