SCHEMBL11065858

SCHEMBL11065858

OCCCNCC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
ADH1B P00325 1/20 0.45
ADH1C P00326 1/20 0.45
ADH1A P07327 1/20 0.45
ADH4 P08319 1/20 0.45
ADH7 P40394 1/20 0.45
EPHX1 P07099 4/20 0.41
GNAI3 P08754 1/20 0.39
GNAO1 P09471 1/20 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
SCHEMBL11064531 0.93 SAT1 (0.45) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL11067343 0.91 EPHX1 (0.47) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL3427404 0.88
SCHEMBL893878 0.88 SAT1 (0.58) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL1761279 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22299782 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL7118925 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL7121343 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL18994769 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL18994695 0.86 ADH1B (0.48) SAT1HDAC3HDAC4HDAC1HDAC7

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-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed