SCHEMBL30749373

SCHEMBL30749373

CC(C)(C)OC(=O)N1CCCCC[C@@H]1c1cc(Cl)ccc1CNc1nc[nH]c1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ TSHR P16473 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ F2 P00734 3/20 0.37
▸ F10 P00742 3/20 0.37
▸ PRSS1 P07477 3/20 0.37
▸ PRSS2 P07478 3/20 0.37
▸ PRSS3 P35030 3/20 0.37
▸ F12 P00748 2/20 0.37
▸ F7 P08709 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ CHEK2 O96017 1/20 0.36
▸ USP30 Q70CQ3 2/20 0.35
▸ UCHL1 P09936 1/20 0.35
▸ EPHA2 P29317 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
SCHEMBL27231711 0.89 F2 (0.36) ALDH1A1F2F10PRSS1PRSS2
SCHEMBL27223541 0.89 F2 (0.36) ALDH1A1F2F10PRSS1PRSS2
SCHEMBL30749212 0.88 ALDH1A1 (0.40) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL27224136 0.88 ALDH1A1 (0.40) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL30749309 0.78 ALDH1A1 (0.37) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL30749308 0.77 ALDH1A1 (0.45) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL27224054 0.77 ALDH1A1 (0.45) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL30749234 0.76 ALDH1A1 (0.54) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL27224081 0.76 ALDH1A1 (0.54) ALDH1A1TSHRLMNAMEN1MAPT
SCHEMBL27224167 0.75 F2 (0.37) ALDH1A1F2F10PRSS1PRSS2

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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