SCHEMBL13894166

SCHEMBL13894166

Cc1cccc(NCCCC(=O)O)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
POLB P06746 1/20 0.49
ITGB3 P05106 1/20 0.48
ITGAV P06756 1/20 0.48
TDP1 Q9NUW8 3/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
AKR1B10 O60218 1/20 0.46
TRPA1 O75762 1/20 0.46

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
SCHEMBL13948424 0.87 MAPT (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13737098 0.84 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12482586 0.84 KDM4E (0.58) POLBTDP1KMT2ALMNAMEN1
SCHEMBL10453654 0.82 MAPT (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL28225592 0.81 MAPT (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL26928986 0.80 KMT2A (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL28304622 0.80 ALDH1A1 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14426828 0.79 HDAC3 (0.73) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11170519 0.78 MAPT (0.67) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL183363 0.78 MAPT (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2

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
EP-2050446-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-04-22 EP disclosed