SCHEMBL23786276

SCHEMBL23786276

CCN(CC)CCCNC(=O)c1cc(NC(=O)c2ccc(/N=N/c3ccccc3)cc2)cc(C(=O)NCCCN(CC)CC)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
MCHR1 Q99705 3/20 0.47
SCN1A P35498 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 0.47
DRD2 P14416 1/20 0.47

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
SCHEMBL23786281 0.90 TDP1 (0.65) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL23904108 0.86 TDP1 (0.64) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL23306815 0.86 TDP1 (0.45) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL12868068 0.85 POLB (0.56) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL13078928 0.84 POLB (0.56) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL24418099 0.83 LMNA (0.66) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL22454031 0.83 HDAC3 (0.46) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL21623603 0.82 TDP1 (0.56) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL1087732 0.82 HDAC3 (0.43) TDP1KMT2AMEN1POLBHDAC3
SCHEMBL23786332 0.80 GRIN1 (0.52) TDP1KMT2AMEN1POLBHDAC3

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-20210278761-A1 COLORING PHOTOSENSITIVE COMPOSITION, FILM, COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2021-09-09 US disclosed