SCHEMBL30530466

SCHEMBL30530466

O=c1c2ccccc2[se]n1-c1ccccc1Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 6/20 0.66
▸ MPI P34949 2/20 0.59
▸ PHOSPHO1 Q8TCT1 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ QSOX1 O00391 1/20 0.59
▸ RGS12 O14924 1/20 0.59
▸ PMM2 O15305 1/20 0.59
▸ PLIN1 O60240 1/20 0.59
▸ GMNN O75496 1/20 0.59
▸ BBOX1 O75936 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ LMNA P02545 1/20 0.59
▸ TP53 P04637 1/20 0.59
▸ CYBB P04839 1/20 0.59
▸ BCHE P06276 1/20 0.59
▸ GLA P06280 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59

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
SCHEMBL29261063 1.00 METAP2 (0.66) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501917 0.83 METAP2 (0.68) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10599445 0.79 METAP2 (1.00) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501672 0.79 MPI (0.72) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501611 0.79 METAP2 (0.66) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL28618904 0.78 METAP2 (0.64) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL28783439 0.77 METAP2 (0.77) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10502183 0.76 METAP2 (1.00) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10502224 0.76 MPI (0.62) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL30988556 0.76 METAP2 (0.65) METAP2MPIPHOSPHO1KDM4EMEN1

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
CN-116789580-A Preparation method and application of selenyne compound 浙江工业大学 2023-09-22 — — CN disclosed
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