SCHEMBL8045674

SCHEMBL8045674

O=C(O)C(Br)C1=CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
ACMSD Q8TDX5 1/20 0.33
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
CTSK P43235 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
HCAR2 Q8TDS4 1/20 0.30
FFAR1 O14842 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
SCHEMBL2919621 0.79 HDAC4 (0.39) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL10171591 0.78 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL988375 0.76 PTGS1 (0.39) HDAC4HDAC2HDAC8HDAC6KMT2A
SCHEMBL3503463 0.76 HDAC4 (0.37) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL5295112 0.74 HDAC4 (0.36) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL11615938 0.74 PTGS1 (0.38) HDAC4HDAC2HDAC8HDAC6KMT2A
SCHEMBL5295105 0.74 HDAC4 (0.36) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL11523501 0.73 HDAC4 (0.35) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL11875790 0.73 HDAC4 (0.35) HDAC4HDAC2HDAC8HDAC6ACMSD
SCHEMBL4119359 0.73 KMT2A (0.36) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6010826-A Resist composition NIPPON ZEON CO., LTD. (JP) 2000-01-04 US disclosed
EP-0786701-A1 RESIST COMPOSITION NIPPON ZEON CO., LTD. (JP) 1997-07-30 EP disclosed