SCHEMBL920192

SCHEMBL920192

CCC(SCC(=O)c1ccc(OC)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 9/20 0.55
HDAC4 P56524 9/20 0.55
HDAC1 Q13547 9/20 0.55
HDAC7 Q8WUI4 9/20 0.55
HDAC2 Q92769 9/20 0.55
HDAC10 Q969S8 9/20 0.55
HDAC11 Q96DB2 9/20 0.55
HDAC8 Q9BY41 9/20 0.55
HDAC6 Q9UBN7 9/20 0.55
HDAC9 Q9UKV0 9/20 0.55
HDAC5 Q9UQL6 9/20 0.55
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GSK3B P49841 1/20 0.49
PDE4B Q07343 1/20 0.48
MMP1 P03956 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL918486 0.83 ALDH1A1 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL918774 0.83 HDAC3 (0.49) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29217316 0.82 KMT2A (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL919146 0.82 HDAC3 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL23879938 0.80 HDAC3 (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10913307 0.76 L3MBTL1 (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1744968 0.75 HTT (0.66) RAB9AMAPT
SCHEMBL10350130 0.74 HDAC3 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10918344 0.73 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL728315 0.73 ALDH1A1 (0.71) HDAC3HDAC4HDAC1HDAC7HDAC2

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-7871998-B2 Diphenylazetidinone derivatives possessing cholesterol absorption inhibitory activity ASTRAZENECA AB (SE) 2011-01-18 US disclosed