SCHEMBL722568

SCHEMBL722568

NNC(=O)CCCc1ccccc1.O=C1C=CC(=O)N1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.55
HDAC2 Q92769 3/20 0.55
HDAC3 O15379 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.50
KDM1A O60341 1/20 0.50
LMNA P02545 2/20 0.49
PKM P14618 1/20 0.49
ALOX5 P09917 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPK1 P28482 1/20 0.49
ADRA1A P35348 1/20 0.49
HDAC4 P56524 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49

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
Hydrochloric Acid SCHEMBL562849 0.99 HDAC1 (0.54) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL6937640 0.87 HDAC1 (0.70) HDAC1HDAC2HDAC3HDAC8HDAC6
Water SCHEMBL28864249 0.86 HDAC1 (0.68) HDAC1HDAC2HDAC3HDAC8HDAC6
Phenylbutanoic Acid SCHEMBL20562049 0.83 HDAC1 (0.72) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL8113734 0.82 HDAC1 (0.69) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL29263701 0.81 HDAC1 (0.72) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL18893638 0.78 HDAC1 (0.50) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL967387 0.77 HDAC2 (0.68) HDAC1HDAC2HDAC8HDAC6L3MBTL1
SCHEMBL28665907 0.75 CTSD (0.47)
SCHEMBL13073412 0.73 HDAC3 (0.78) HDAC1HDAC2HDAC3HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013013700-A1 MULTIVALENT ANTIGEN-BINDING FV MOLECULE AFFIMED THERAPEUTICS AG (DE) 2013-01-31 WO disclosed
WO-2012027493-A1 MOLECULAR IMAGING OF CANCER CELLS IN VIVO H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2012-03-01 WO disclosed
US-7727720-B2 Methods for detection of genetic disorders RAVGEN, INC. (US) 2010-06-01 US disclosed
US-7442506-B2 Methods for detection of genetic disorders RAVGEN, INC. (US) 2008-10-28 US disclosed
US-20070178478-A1 Methods for detection of genetic disorders RAVGEN, INC. 2007-08-02 US disclosed
US-20060160105-A1 Methods for detection of genetic disorders RAVGEN, INC. (US) 2006-07-20 US disclosed
US-20060121452-A1 Methods for detection of genetic disorders RAVGEN, INC. (US) 2006-06-08 US disclosed