SCHEMBL28367385

SCHEMBL28367385

Cc1ccc(C(=O)C(CC(=O)c2ccccc2)c2ccc(C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.62
NPC1 O15118 4/20 0.57
KMT2A Q03164 4/20 0.57
RAB9A P51151 3/20 0.57
MEN1 O00255 2/20 0.57
L3MBTL1 Q9Y468 4/20 0.55
MGAM O43451 1/20 0.53
GAA P10253 1/20 0.53
SI P14410 1/20 0.53
MGAM2 Q2M2H8 1/20 0.53
LMNA P02545 6/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
KDM4E B2RXH2 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HSD17B10 Q99714 1/20 0.49
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
TSHR P16473 1/20 0.46

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
SCHEMBL29110239 0.98 POLB (0.60) POLBNPC1KMT2ARAB9AMEN1
SCHEMBL11521612 0.97 POLB (0.58) POLBNPC1KMT2ARAB9AMEN1
SCHEMBL6201780 0.87 LMNA (0.65) KMT2ARAB9AMEN1L3MBTL1MGAM
SCHEMBL29110346 0.86 POLB (0.78) POLBNPC1KMT2ARAB9AMEN1
SCHEMBL29110164 0.84 TSHR (0.54) POLBNPC1KMT2ARAB9AL3MBTL1
SCHEMBL29110188 0.83 POLB (0.61) POLBKMT2AMEN1L3MBTL1MGAM
SCHEMBL29110155 0.83 SMN1; SMN2 (0.53) POLBKMT2ARAB9AMEN1L3MBTL1
SCHEMBL29110265 0.83 KMT2A (0.60) POLBNPC1KMT2ARAB9AMEN1
SCHEMBL28996266 0.82 LMNA (0.49) POLBNPC1KMT2ARAB9AMEN1
SCHEMBL29110194 0.82 L3MBTL1 (0.71) POLBNPC1KMT2ARAB9AMEN1

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
CN-106966877-B 1, 4-dicarbonyl compound and preparation method thereof 郑州大学 2020-02-07 CN disclosed