SCHEMBL24653262

SCHEMBL24653262

CNC(=O)CCCCCNC(=O)c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 10/20 0.75
HDAC6 Q9UBN7 9/20 0.75
HDAC2 Q92769 8/20 0.75
HDAC3 O15379 7/20 0.75
HDAC8 Q9BY41 7/20 0.75
HDAC4 P56524 5/20 0.75
HDAC10 Q969S8 5/20 0.75
HDAC11 Q96DB2 5/20 0.75
HDAC9 Q9UKV0 5/20 0.75
HDAC5 Q9UQL6 5/20 0.75
HDAC7 Q8WUI4 4/20 0.75
NAAA Q02083 1/20 0.67
MAPK1 P28482 1/20 0.61
NCOR2 Q9Y618 1/20 0.60
HTT P42858 3/20 0.59
KDM4E B2RXH2 2/20 0.59
GAA P10253 1/20 0.59
ALDH1A1 P00352 1/20 0.58

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
SCHEMBL20684933 1.00 HDAC1 (0.75) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL24653245 0.91 HDAC1 (0.78) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL15725415 0.89 HDAC6 (0.79) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL15725405 0.88 HDAC6 (0.79) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL24709351 0.87 HDAC1 (0.59) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL5680628 0.87 PRSS1 (0.62) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL14617489 0.86 L3MBTL1 (0.68) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL573254 0.86 HDAC6 (1.00) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL1232912 0.86 HDAC6 (1.00) HDAC1HDAC6HDAC2HDAC3HDAC8
SCHEMBL7371325 0.85 HDAC1 (0.79) HDAC1HDAC6HDAC2HDAC3HDAC8

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-20220315926-A1 An Aptamer for Dengue Virus and Related Methods and Products AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2022-10-06 US disclosed