SCHEMBL23319296

SCHEMBL23319296

CSCCC(NC(=O)C(O)C[Se]C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
LTA4H P09960 1/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
FOLH1 Q04609 1/20 0.41
CA2 P00918 2/20 0.41
MAPK1 P28482 2/20 0.41
CA1 P00915 1/20 0.41
FNTA P49354 2/20 0.41
FNTB P49356 2/20 0.41
PGGT1B P53609 1/20 0.41
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL18485876 1.00 LMNA (0.46) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18485872 1.00 LMNA (0.46) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18485873 1.00 LMNA (0.46) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18485882 1.00 LMNA (0.46) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18485886 1.00 LMNA (0.46) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18764132 0.85 ALDH1A1 (0.47) ALDH1A1USP2
SCHEMBL18764106 0.85 ALDH1A1 (0.47) ALDH1A1USP2
SCHEMBL18764109 0.85 ALDH1A1 (0.47) ALDH1A1USP2
SCHEMBL18782968 0.84 LMNA (0.50) LMNALTA4HALDH1A1NPSR1FOLH1
SCHEMBL18782970 0.84 LMNA (0.50) LMNALTA4HALDH1A1NPSR1FOLH1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3129014-B1 NOVEL ORGANOSELENIUM COMPOUNDS, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL USES THEREOF AS ANTITUMOUR AGENTS TETRAHEDRON (FR) 2021-05-12 EP claimed