SCHEMBL27601367

SCHEMBL27601367

CC(C)c1c(O)ccc(-c2ccccc2)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.45
ALOX5 P09917 2/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
BCL2L1 Q07817 1/20 0.43
HDAC4 P56524 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ABCB1 P08183 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
PDE4B Q07343 4/20 0.41
PDE4A P27815 3/20 0.41
PDE4C Q08493 3/20 0.41
PDE4D Q08499 3/20 0.41
AHR P35869 1/20 0.41
ESR2 Q92731 1/20 0.40
MEN1 O00255 2/20 0.39

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
SCHEMBL8758997 0.87 BACE1 (0.43) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL10818953 0.85 BACE1 (0.45) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL28658649 0.80 PDE4B (0.57) BACE1ALOX5ALDH1A1HPGDHSD17B10
Isobutane SCHEMBL27537403 0.80 BACE1 (0.48) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL9454130 0.80 AHR (0.43) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL28856459 0.80 ALDH1A1 (0.58) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL5069431 0.78 ALDH1A1 (0.56) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL29280771 0.78 CA1 (0.45) ALDH1A1HPGDBCL2L1ABCB1GABRA1
SCHEMBL2654207 0.78 BACE1 (0.38) BACE1ALOX5ALDH1A1HPGDHSD17B10
SCHEMBL6838848 0.77 CDC25A (0.41) BACE1ALOX5ALDH1A1HPGDHSD17B10

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-1656177-A Fire retardant resin composition, method of its production, shaped articles comprising the same, and silica NIPPON CATALYTIC CHEM IND (JP) 2005-08-17 CN disclosed