SCHEMBL28099690

SCHEMBL28099690

NC(=O)c1ccc(NC(=O)c2ccccc2)c(NC(=O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.59
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
NPC1 O15118 1/20 0.57
PLAU P00749 1/20 0.55
HDAC1 Q13547 6/20 0.54
HDAC3 O15379 1/20 0.54
MAPK1 P28482 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 4/20 0.54
HDAC6 Q9UBN7 4/20 0.54
MAPT P10636 2/20 0.54
PDCD1 Q15116 1/20 0.54
CD274 Q9NZQ7 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
PKM P14618 1/20 0.53
GRIK1 P39086 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL10953014 0.81 HDAC3 (0.71) F10MEN1KMT2ANPC1HDAC1
SCHEMBL4926542 0.80 HDAC1 (0.73) HDAC1HDAC2PDCD1CD274
SCHEMBL1110180 0.79 MDM4 (0.73) F10MEN1KMT2ANPC1HDAC1
SCHEMBL1664024 0.79 MEN1 (0.59) F10MEN1KMT2ANPC1HDAC1
SCHEMBL16317646 0.77 KCNMA1 (0.76) MEN1KMT2ANPC1MAPTCYP1A2
SCHEMBL3793263 0.77 KCNMA1 (0.76) MEN1KMT2ANPC1MAPT
SCHEMBL4004339 0.77 KCNK3 (0.76) MEN1KMT2ANPC1PLAU
SCHEMBL7409499 0.77 MEN1 (0.61) F10MEN1KMT2ANPC1HDAC1
N-Phenylbenzamide SCHEMBL18889922 0.77 PTPN1 (0.70) MEN1KMT2ANPC1PLAUHDAC1
SCHEMBL3902965 0.77 KMT2A (0.72) MEN1KMT2ANPC1PLAUMAPT

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
CN-105985276-A 3,4-dibenzamido benzamide derivative, preparation method and application thereof 南京中瑞药业有限公司 2016-10-05 CN disclosed
CN-105985276-A 3,4-dibenzamido benzamide derivative, preparation method and application thereof 南京中瑞药业有限公司 2016-10-05 CN disclosed