SCHEMBL25870828

SCHEMBL25870828

O=C1C(=Cc2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)[se]2)C(=O)c2cc3ccccc3cc21

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
USP2 O75604 1/20 0.30
PKM P14618 1/20 0.30
APAF1 O14727 1/20 0.30
CASP3 P42574 1/20 0.30
CASP6 P55212 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30

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
SCHEMBL25870797 0.94 LCK (0.34) MAPTKMT2AMEN1HPGDCDC25A
SCHEMBL17765710 0.85 SIGMAR1 (0.31)
SCHEMBL17765731 0.82
SCHEMBL25870801 0.81 LCK (0.33) MAPTKMT2AMEN1HPGDCDC25A
SCHEMBL25870812 0.79 GSK3B (0.31)
SCHEMBL25870824 0.79
SCHEMBL25870811 0.78 CA1 (0.31)
SCHEMBL25870785 0.78 ACLY (0.32)
SCHEMBL29993362 0.78 PTPN1 (0.35) MAPTKMT2AMEN1HPGDL3MBTL1
SCHEMBL17765829 0.78 PTPN1 (0.35) MAPTKMT2AMEN1HPGDL3MBTL1

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
US-11711930-B2 2023-07-25 US disclosed