SCHEMBL28526734

SCHEMBL28526734

O=C1Nc2ccc(Br)cc2C12CC2(c1ccccc1)c1ccccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
MAPT P10636 3/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALPL P05186 1/20 0.42
HSP90AA1 P07900 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
TLR9 Q9NR96 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC27A2 O14975 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 2/20 0.40
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
GABRA1 P14867 1/20 0.38

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
SCHEMBL29619573 0.88 SLC27A2 (0.46) LMNAMAPTGAAMEN1KMT2A
SCHEMBL28515905 0.88 SLC27A2 (0.46) LMNAMAPTGAAMEN1KMT2A
SCHEMBL28522164 0.85 TP53 (0.42) LMNAMAPTGAAMEN1KMT2A
SCHEMBL29619616 0.76 LMNA (0.40) LMNAMAPTGAAMEN1KMT2A
SCHEMBL28519633 0.76 KMT2A (0.40) LMNAMAPTGAAMEN1KMT2A
SCHEMBL28528531 0.76 LMNA (0.42) LMNAMAPTGAAMEN1KMT2A
SCHEMBL29619589 0.75 ADAMTS5 (0.39) LMNAMAPTGAAMEN1KMT2A
SCHEMBL29619607 0.69 HTR6 (0.39) LMNAMAPTMEN1KMT2AADAMTS5
SCHEMBL16107692 0.69 HTR6 (0.56) LMNAMAPTGAAMEN1KMT2A
SCHEMBL16197245 0.69 BRD4 (0.52) LMNAMAPTGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112250614-B Synthesis method of 3-spiro-tricyclic indolone derivative 苏州大学 2022-02-01 CN disclosed
CN-112250614-A Synthesis method of 3-spiro-tricyclic indolone derivative 苏州大学 2021-01-22 CN disclosed