SCHEMBL6315636

SCHEMBL6315636

C=CC(=O)NCCCC(=O)c1nc2ccccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 2/20 0.56
SMYD3 Q9H7B4 1/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
FAAH O00519 1/20 0.42
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
KCNH2 Q12809 1/20 0.42
HTT P42858 3/20 0.41
POLB P06746 2/20 0.41

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
SCHEMBL6316263 0.82 DAGLA (0.58) DAGLASMYD3MAPTMEN1KMT2A
SCHEMBL432107 0.80 POLB (0.62) MAPTMEN1KMT2AHTTPOLB
SCHEMBL10464100 0.77 DAGLA (0.64) DAGLASMYD3MAPTFAAHHDAC3
SCHEMBL27573148 0.76 DAGLA (0.76) DAGLAMAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL11073930 0.74 SMYD3 (0.55) DAGLASMYD3MAPTMEN1KMT2A
SCHEMBL10462915 0.74 DAGLA (0.63) DAGLASMYD3MAPTMEN1KMT2A
SCHEMBL6314871 0.74 ZDHHC20 (0.41) KMT2ATDP1GAATGM2
SCHEMBL7051953 0.73 DAGLA (0.60) DAGLASMYD3MAPTMEN1KMT2A
SCHEMBL6039391 0.72 DAGLA (0.57) DAGLAMAPTMEN1KMT2AFAAH
SCHEMBL28491473 0.72 XDH (0.62) DAGLASMYD3MAPTMEN1KMT2A

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-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US claimed
US-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US disclosed