SCHEMBL24909629

SCHEMBL24909629

CCN(CC)C(=O)C(Cc1ccc(O)cc1)N1C(=O)c2cc(Oc3ccc(C(C)C)cc3C)c3c4c(Oc5ccc(C(C)C)cc5C)cc5c6c(cc(Oc7ccc(C(C)C)cc7C)c(c7c(Oc8ccc(C(C)C)cc8C)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1ccc(O)cc1)C(=O)N(CC)CC)C5=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.37
MEN1 O00255 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL24909394 0.96 POLB (0.37) POLBKMT2ACYP2D6MEN1TDP1
SCHEMBL24909390 0.82 ALDH1A1 (0.40) POLBKMT2AALDH1A1GAAL3MBTL1
SCHEMBL24704857 0.80 ALDH1A1 (0.44) POLBKMT2ACYP2D6MEN1TDP1
SCHEMBL24909307 0.79 POLB (0.54) POLBKMT2ACYP2D6MEN1TDP1
SCHEMBL24909295 0.78 POLB (0.38) POLBKMT2ACYP2D6MEN1TDP1
SCHEMBL24909294 0.76 POLB (0.46) POLBKMT2ACYP2D6MEN1TDP1
SCHEMBL24909075 0.76 BCHE (0.31) BCHEACHEALDH1A1
SCHEMBL24909187 0.76 SMN1; SMN2 (0.42) POLBKMT2AMEN1ALDH1A1GAA
SCHEMBL24909200 0.75 ALDH1A1 (0.39) POLBKMT2ABCHEACHEALDH1A1
SCHEMBL24908692 0.74 POLB (0.42) POLBKMT2AMEN1ALDH1A1GAA

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-20230023648-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM PREPARED USING SAME, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD (KR) 2023-01-26 US disclosed