SCHEMBL28417403

SCHEMBL28417403

C1=C([Mg]C2=CCCCC2)CCCC1.O=PO

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL8215576 0.78 HDAC3 (0.31) HDAC4HDAC2HDAC8HDAC6
Hydrochloric Acid SCHEMBL9472826 0.76 HDAC3 (0.30) HDAC4HDAC2HDAC8HDAC6
SCHEMBL28250774 0.73 ACMSD (0.40) HDAC4HDAC2HDAC8HDAC6
SCHEMBL28419782 0.70 HDAC4 (0.35) HDAC4HDAC2HDAC8HDAC6
SCHEMBL1452500 0.67
SCHEMBL4446600 0.67
SCHEMBL3156924 0.63
SCHEMBL17366069 0.62
SCHEMBL27999236 0.61 HDAC4 (0.34) HDAC4HDAC2HDAC8HDAC6
SCHEMBL28531234 0.61

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-111350099-A Insulating flame retardant for packaging paper and preparation method and application thereof 青岛科技大学 2020-06-30 CN claimed
CN-111350099-A Insulating flame retardant for packaging paper and preparation method and application thereof 青岛科技大学 2020-06-30 CN disclosed