SCHEMBL25626564

SCHEMBL25626564

CCOC(=O)C(Br)CC(CCC(CC(Br)C(=O)OCC)C(=O)OCC)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.40
ALDH1A1 P00352 3/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 1/20 0.37
TRPA1 O75762 1/20 0.37
ZDHHC7 Q9NXF8 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 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
SCHEMBL25626565 0.90 ZDHHC7 (0.49) CPB2ALDH1A1KMT2AMEN1NPC1
SCHEMBL25626568 0.88 ALDH1A1 (0.40) CPB2ALDH1A1KMT2AMEN1ZDHHC7
SCHEMBL24169913 0.86 ALDH1A1 (0.40) CPB2ALDH1A1KMT2AMEN1NPC1
SCHEMBL1286734 0.84 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1NPC1TRPA1
SCHEMBL14016338 0.84 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1NPC1TRPA1
SCHEMBL25626562 0.82 HSD17B10 (0.48) ALDH1A1KMT2AMEN1NPC1LMNA
SCHEMBL25626566 0.81 ALDH1A1 (0.44) ALDH1A1ZDHHC7LMNAL3MBTL1CYP2D6
SCHEMBL240521 0.80 ZDHHC7 (0.47) CPB2ALDH1A1KMT2AMEN1TRPA1
SCHEMBL36999 0.80 ZDHHC7 (0.47) CPB2ALDH1A1KMT2AMEN1TRPA1
SCHEMBL25626563 0.79 TDP1 (0.47) ALDH1A1KMT2AMEN1NPC1LMNA

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-11667790-B2 Polymer having reactive silicon-containing group and production method therefor SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-06 US disclosed