SCHEMBL12384635

SCHEMBL12384635

CC(C)C1CCN(C(=O)C(C)N(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.37
DPP4 P27487 6/20 0.36
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 3/20 0.36
DPP7 Q9UHL4 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
EPHX2 P34913 3/20 0.36

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
SCHEMBL12424408 0.83 ALDH1A1 (0.61) MEN1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL25933055 0.81 MEN1 (0.42) MEN1KMT2AALDH1A1SMN1; SMN2DPP4
SCHEMBL2603237 0.80 MEN1 (0.47) MEN1KMT2AALDH1A1DPP4DPP8
SCHEMBL12385976 0.79 CYP2D6 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2DPP4
SCHEMBL14147221 0.79 MEN1 (0.46) MEN1KMT2AALDH1A1DPP4DPP8
SCHEMBL14147672 0.79 MEN1 (0.46) MEN1KMT2AALDH1A1DPP4DPP8
SCHEMBL12125453 0.79 KMT2A (0.56) MEN1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL13403905 0.79 MEN1 (0.46) MEN1KMT2AALDH1A1DPP4DPP8
SCHEMBL8261295 0.78 ALDH1A1 (0.39) MEN1KMT2AALDH1A1SMN1; SMN2DPP4
SCHEMBL25068495 0.77 SMYD3 (0.49) MEN1KMT2AALDH1A1DPP4DPP8

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
US-8461328-B2 Tricyclic heterocyclic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2013-06-11 US disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 MEN1 298/4885KMT2A 1997/4885ALDH1A1 1168/4885

“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.