SCHEMBL8000409

SCHEMBL8000409

O=CNNC(=O)CCCCCCCCCCC(=O)NNC=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC5 Q9UQL6 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
BLM P54132 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FAAH O00519 3/20 0.37
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL23988250 0.87 HDAC3 (0.34) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL23987888 0.87 HSP90AA1 (0.52) HSP90AA1ALDH1A1MEN1KMT2ANPSR1
SCHEMBL23735559 0.85 KMT2A (0.43) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL18470774 0.80
SCHEMBL16015581 0.78
SCHEMBL21641977 0.76 ALDH1A1 (0.41) ALDH1A1POLBNPSR1GAA
SCHEMBL23735557 0.75 NPSR1 (0.38) SMN1; SMN2ALDH1A1KMT2ANPSR1
SCHEMBL27921858 0.72
SCHEMBL28097747 0.72
SCHEMBL9436102 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6140004-A LAMINATION A SUBSTRATE AND CHARGE TRANSPORT LAYER IMATION CORP. (US) 2000-10-31 US disclosed
US-6066426-A ORGANIC PHOTORECEPTOR COMPRISING ARYLHYDRAZONE OF 3-FORMYL CARBAZOLE AS CHARGE TRANSPORT COMPOUND IMATION CORP. (US) 2000-05-23 US disclosed
WO-2000022483-A1 ORGANIC PHOTORECEPTORS FOR ELECTROPHOTOGRAPHY CONTAINING HYDRAZONE CHARGE TRANSPORT COMPOUNDS IMATION CORP. (US) 2000-04-20 WO disclosed