SCHEMBL25870797

SCHEMBL25870797

O=C1C(=Cc2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)[se]2)C(=O)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
MAPT P10636 5/20 0.33
KMT2A Q03164 5/20 0.33
USP2 O75604 1/20 0.33
PKM P14618 1/20 0.33
MEN1 O00255 4/20 0.33
ALDH1A1 P00352 2/20 0.33
APP P05067 2/20 0.33
ALPL P05186 1/20 0.33
ALPI P09923 1/20 0.33
ALPG P10696 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
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

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
SCHEMBL25870828 0.94 MAPT (0.32) MAOAMAOBMAPTKMT2AUSP2
SCHEMBL25870801 0.86 LCK (0.33) LCKMAOAMAOBMAPTKMT2A
SCHEMBL29993362 0.84 PTPN1 (0.35) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL17765829 0.84 PTPN1 (0.35) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL19563492 0.80 LCK (0.44) LCKMAPTKMT2AUSP2PKM
SCHEMBL17765710 0.80 SIGMAR1 (0.31)
SCHEMBL25870774 0.79 ALDH1A1 (0.32) MAPTKMT2AALDH1A1HPGDTDP1
SCHEMBL25870782 0.78 MAPT (0.36) LCKMAOBMAPTKMT2AUSP2
SCHEMBL25870779 0.78 PTPN1 (0.38) LCKMAPTKMT2APKMMEN1
SCHEMBL25870785 0.77 ACLY (0.32)

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