SCHEMBL30749213

SCHEMBL30749213

CC(C)(C)OC(=O)N1CCOCC1c1cc(Cl)ccc1C=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ CCNC P24863 1/20 0.39
▸ CDK8 P49336 1/20 0.39
▸ MALT1 Q9UDY8 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ GRM5 P41594 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ USP30 Q70CQ3 1/20 0.36
▸ ENPP2 Q13822 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ SMN1; SMN2 Q16637 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
SCHEMBL27224118 1.00 TSHR (0.42) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL27224064 0.86 ALDH1A1 (0.51) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL30749329 0.86 ALDH1A1 (0.51) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL31556713 0.85 NR1H2 (0.39) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL30899777 0.85 NR1H2 (0.39) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL30749316 0.85 ALDH1A1 (0.48) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL27224030 0.85 ALDH1A1 (0.48) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL31556715 0.84 ALDH1A1 (0.47) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL30749292 0.84 ALDH1A1 (0.47) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL27224046 0.83 CCNC (0.41) MEN1KMT2ALMNAALDH1A1CCNC

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
EP-4573096-A1 INHIBITORS OF MYELOPEROXIDASE Astrazeneca AB (SE) 2025-06-25 — — EP disclosed
WO-2024038131-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-02-22 — — WO disclosed
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