SCHEMBL17610296

SCHEMBL17610296

CC(C)(C)OC(=O)NNC1CCN(Cc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ MCHR1 Q99705 1/20 0.53
▸ BCHE P06276 5/20 0.52
▸ ACHE P22303 5/20 0.52
▸ BACE1 P56817 5/20 0.52
▸ DRD2 P14416 7/20 0.52
▸ DRD4 P21917 7/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ KCNA3 P22001 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.50
▸ DPP7 Q9UHL4 1/20 0.49

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
SCHEMBL1934958 0.93 KMT2A (0.54) KMT2AL3MBTL1BCHEACHEDRD2
SCHEMBL3635817 0.93 KMT2A (0.56) KMT2AL3MBTL1MCHR1BCHEDRD2
SCHEMBL2241423 0.89 KMT2A (0.63) KMT2AL3MBTL1MCHR1BCHEACHE
SCHEMBL178929 0.89 KMT2A (0.63) KMT2AL3MBTL1MCHR1BCHEACHE
SCHEMBL2241424 0.89 KMT2A (0.63) KMT2AL3MBTL1MCHR1BCHEACHE
SCHEMBL1412221 0.85 KMT2A (0.58) KMT2AL3MBTL1MCHR1DRD2DRD4
SCHEMBL1412219 0.85 KMT2A (0.58) KMT2AL3MBTL1MCHR1DRD2DRD4
SCHEMBL915402 0.84 KMT2A (0.65) KMT2AL3MBTL1MCHR1DRD2DRD4
SCHEMBL555251 0.84 KMT2A (0.62) KMT2AL3MBTL1MCHR1DRD2DRD4
SCHEMBL1412348 0.83 KMT2A (0.56) KMT2AL3MBTL1MCHR1BACE1DRD2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170291890-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF Epizyme, Inc. 2017-10-12 — — US disclosed
US-20170291890-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF Epizyme, Inc. 2017-10-12 — — US disclosed
EP-3194377-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2017-07-26 — — EP disclosed
WO-2016044666-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2016-03-24 — — WO disclosed
WO-2016044666-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2016-03-24 — — 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-20170291890-A1 HETEROCYCLE SUBSTITUTED AMINO-PYRIDINE COMPOUNDS AND METHODS OF USE THEREOF HCCS, TP53, NME2 KMT2A 2175/4885L3MBTL1 4229/4885MCHR1 4182/4885

“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.

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