SCHEMBL11440488

SCHEMBL11440488

COP(=O)(CCCN(O)C=O)OC

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 4/20 0.33
HDAC8 Q9BY41 4/20 0.33
HDAC6 Q9UBN7 3/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 1/20 0.30
HDAC9 Q9UKV0 1/20 0.30
HDAC5 Q9UQL6 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
SCHEMBL18625781 0.85 HDAC1 (0.32) HDAC2HDAC8HDAC6HDAC1
SCHEMBL10792757 0.83 HDAC1 (0.36) HDAC2HDAC8HDAC6HDAC1
SCHEMBL6935159 0.81 PPARD (0.47)
SCHEMBL18161031 0.76 GABBR2 (0.45) HDAC2HDAC8HDAC6HDAC1
Fosmidomycin SCHEMBL301404 0.75 TYMS (0.48)
SCHEMBL6537250 0.75 LPAR3 (0.46)
Fosmidomycin SCHEMBL11438018 0.74 TYMS (0.46)
Fosmidomycin SCHEMBL4432380 0.74 TYMS (0.46)
SCHEMBL11437191 0.73
Fosmidomycin SCHEMBL14485270 0.73 S1PR2 (0.50)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4182758-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-08 US claimed
US-4206156-A ANTIMICROBIAL FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1980-06-03 US disclosed
US-4182758-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-08 US disclosed