SCHEMBL4529328

SCHEMBL4529328

NCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NO

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 8/20 0.75
HDAC8 Q9BY41 8/20 0.75
HDAC6 Q9UBN7 5/20 0.75
HDAC3 O15379 4/20 0.75
HDAC2 Q92769 4/20 0.75
HDAC5 Q9UQL6 3/20 0.75
HSP90AA1 P07900 1/20 0.60
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
PLG P00747 1/20 0.54
LMNA P02545 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
SLC6A2 P23975 1/20 0.54
RECQL P46063 1/20 0.54
SLC6A3 Q01959 1/20 0.54
KMT2A Q03164 1/20 0.54
PAOX Q6QHF9 1/20 0.52
HDAC10 Q969S8 3/20 0.50
NCOR2 Q9Y618 3/20 0.50

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
SCHEMBL4534274 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4538394 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4528486 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4525104 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4529563 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4538539 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4527933 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4523492 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4529176 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2
SCHEMBL4531251 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC6HDAC3HDAC2

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-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 US disclosed
WO-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 WO disclosed