SCHEMBL25870782

SCHEMBL25870782

O=C1C(=Cc2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3)[se]2)C(=O)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.36
KMT2A Q03164 5/20 0.36
PKM P14618 3/20 0.36
USP2 O75604 1/20 0.36
LCK P06239 2/20 0.34
L3MBTL1 Q9Y468 5/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 1/20 0.34
ALDH1A1 P00352 7/20 0.33
HTT P42858 4/20 0.33
HPGD P15428 3/20 0.33
POLB P06746 3/20 0.33
MEN1 O00255 2/20 0.33
ALPL P05186 1/20 0.33
ALPI P09923 1/20 0.33
ALPG P10696 1/20 0.33
HIF1A Q16665 1/20 0.33
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
NFKB1 P19838 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
SCHEMBL25870777 0.89 PTPN1 (0.32) MAPTKMT2APKMUSP2
SCHEMBL25870797 0.78 LCK (0.34) MAPTKMT2APKMUSP2LCK
SCHEMBL25870810 0.78 MAOB (0.32) KMT2APKMMEN1MAOB
SCHEMBL25870779 0.77 PTPN1 (0.38) MAPTKMT2APKMLCKL3MBTL1
SCHEMBL12761710 0.77 LCK (0.51) MAPTKMT2APKMUSP2LCK
SCHEMBL25870801 0.76 LCK (0.33) MAPTKMT2APKMUSP2LCK
SCHEMBL17765829 0.76 PTPN1 (0.35) MAPTKMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL25870774 0.76 ALDH1A1 (0.32) MAPTKMT2AALDH1A1HTTHPGD
SCHEMBL25870828 0.75 MAPT (0.32) MAPTKMT2APKMUSP2L3MBTL1
SCHEMBL17765710 0.74 SIGMAR1 (0.31)

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