SCHEMBL5873456

SCHEMBL5873456

C/C=C(\CO)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC3 O15379 1/20 0.57
NCOR2 Q9Y618 1/20 0.57
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
ATM Q13315 1/20 0.38
CES1 P23141 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL15816134 1.00 HDAC1 (0.57) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL5873458 1.00 HDAC1 (0.57) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438248 0.81 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438252 0.81 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438249 0.81 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL24376117 0.80 HDAC1 (0.57) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6027480 0.80 ATM (0.48) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL515423 0.80 ATM (0.48) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL515424 0.80 ATM (0.48) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL7035017 0.78 HDAC1 (0.55) HDAC1HDAC2HDAC3NCOR2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed
US-20060004123-A1 PHASE CHANGE INK PRINTING PROCESS XEROX CORPORATION 2006-01-05 US claimed
US-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US disclosed
US-20060004123-A1 PHASE CHANGE INK PRINTING PROCESS XEROX CORPORATION 2006-01-05 US disclosed