SCHEMBL11267110

SCHEMBL11267110

O=C(O)OC1=CCCCC1.[Mo]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
ACMSD Q8TDX5 1/20 0.33
GSTP1 P09211 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CTSK P43235 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
FFAR1 O14842 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL3409037 0.98 HDAC4 (0.39) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL10801637 0.96 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL29174091 0.96 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL933788 0.91
SCHEMBL20440725 0.83 HDAC4 (0.41) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL166015 0.83 HDAC4 (0.41) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL28513012 0.82 HDAC4 (0.35) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL20440727 0.82 HDAC4 (0.37) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL2185733 0.81 HDAC4 (0.39) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL20440728 0.81 HDAC4 (0.39) HDAC4HDAC2HDAC8HDAC6ACMSD

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-4322515-A FROM LIQUID PYROLYZATES OF PETROLEUM HYDROCARBONS USING A PEROXIDE AND A CARBOXY ACID METAL SALT ALIEV SAKHIB M O 1982-03-30 US disclosed