SCHEMBL30765950

SCHEMBL30765950

CO[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2Oc1ncc(NCCCc2ccccc2)c(=O)n1CC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 6/20 0.38
KLK7 P49862 7/20 0.36
KLK5 Q9Y337 5/20 0.36
KDM4E B2RXH2 3/20 0.35
ASPH Q12797 2/20 0.35
RIOX2 Q8IUF8 2/20 0.35
KDM8 Q8N371 2/20 0.35
ALDH1A1 P00352 2/20 0.35
F2 P00734 1/20 0.34
SLC2A1 P11166 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
KDM6B O15054 1/20 0.33
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL30765503 0.90 BCHE (0.41) BCHEKDM4EASPHRIOX2KDM8
SCHEMBL31558528 0.89 BCHE (0.40) BCHEKDM4EASPHRIOX2KDM8
SCHEMBL30765476 0.88 ELANE (0.40) BCHEKLK7KLK5KDM4EALDH1A1
SCHEMBL30765744 0.88 BCHE (0.38) BCHEKDM4EASPHRIOX2KDM8
SCHEMBL30766052 0.81 KLK7 (0.42) BCHEKLK7KLK5
SCHEMBL30765946 0.79 F2 (0.39) BCHEF2KDM6BKDM4C
SCHEMBL30765978 0.79 ELANE (0.41) BCHEKDM4EASPHRIOX2KDM8
SCHEMBL30765994 0.77 ELANE (0.46) KDM4EASPHRIOX2KDM8ALDH1A1
SCHEMBL30765644 0.77 KDM4E (0.42) KDM4EASPHRIOX2KDM8ALDH1A1
SCHEMBL30765914 0.76 ELANE (0.39) KDM4EASPHRIOX2KDM8ALDH1A1

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-4568666-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Alexion Pharmaceuticals, Inc. (US) 2025-06-18 EP disclosed
WO-2024035686-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2024-02-15 WO disclosed