SCHEMBL30749254

SCHEMBL30749254

CCOC(=O)c1[nH]ccc1NCc1ccccc1C1CCCCCN1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ ALDH1A1 P00352 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ TSHR P16473 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ KDM1A O60341 1/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ EPHX2 P34913 1/20 0.34

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
SCHEMBL27224042 1.00 KMT2A (0.46) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL27223426 0.99 KMT2A (0.47) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL30749239 0.99 KMT2A (0.47) KMT2AMEN1ALDH1A1LMNATP53
Hydrochloric Acid SCHEMBL30749296 0.93 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL27224168 0.90 ALOX15 (0.39) KMT2AMEN1ALDH1A1KDM4EALOX15
SCHEMBL27224058 0.89 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1KDM4EALOX15
SCHEMBL30749308 0.88 ALDH1A1 (0.45) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL27224054 0.88 ALDH1A1 (0.45) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL30749240 0.87 MEN1 (0.40) KMT2AMEN1ALDH1A1LMNATP53
SCHEMBL31556733 0.87 MEN1 (0.40) KMT2AMEN1ALDH1A1LMNATP53

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
EP-4573096-A1 INHIBITORS OF MYELOPEROXIDASE Astrazeneca AB (SE) 2025-06-25 — — EP disclosed
CN-119894896-A Inhibitors of green peroxidase 阿斯利康(瑞典)有限公司 2025-04-25 — — CN disclosed
WO-2024038131-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-02-22 — — WO disclosed
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