SCHEMBL21739823

SCHEMBL21739823

CC(C)C1CCN(C(=O)N(C)C)C1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
HSD17B10 Q99714 1/20 0.46
PDE4B Q07343 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.35
DPP4 P27487 3/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 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
SCHEMBL9918326 0.89 MEN1 (0.46) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL9918307 0.89 MEN1 (0.46) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL12125453 0.88 KMT2A (0.56) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL23338576 0.85 MEN1 (0.36) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL20232928 0.84 GAA (0.38) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL19735105 0.84 KMT2A (0.42) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL12384620 0.80 GAA (0.38) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL13035374 0.80 CPN1 (0.38) MEN1KMT2AGAAALDH1A1DPP4
SCHEMBL679537 0.80 PIK3CD (0.38) MEN1KMT2AALDH1A1DPP4DPP8
SCHEMBL15837591 0.80 PIK3CD (0.38) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023172737-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-09-14 WO disclosed
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2023-05-04 US disclosed
WO-2023015559-A1 MACROCYCLE COMPOUNDS AS INHIBITORS OF RAS NUTSHELL BIOTECH (SHANGHAI) CO., LTD. (CN) 2023-02-16 WO disclosed
WO-2022159818-A1 POLY(ADP-RIBOSE) GLYCOHYDROLASE (PARG) INHIBITORS AGAINST COVID MACRODOMAIN AND METHODS OF USING THE SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-07-28 WO disclosed
WO-2020037079-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2020-02-20 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-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 MEN1 2641/4885KMT2A 52/4885SMN1; SMN2 2240/4885

“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.