SCHEMBL21457763

SCHEMBL21457763

C=CNC(=O)c1cc2ccccc2cc1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
GAA P10253 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MITF O75030 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
IRAK4 Q9NWZ3 1/20 0.43
PARP1 P09874 4/20 0.42
IDO1 P14902 1/20 0.40
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
EGFR P00533 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL225451 0.82 KDM4E (0.45) KDM4EALDH1A1GAAMAPTIRAK4
SCHEMBL10934947 0.80 IKBKB (0.55) IKBKBKDM4EALDH1A1GAAMEN1
SCHEMBL1004596 0.80 KDM4E (0.63) IKBKBKDM4EALDH1A1GAAMEN1
SCHEMBL21457542 0.79 PARP1 (0.44) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL7404678 0.78 KDM4E (0.61) IKBKBKDM4EALDH1A1GAAMEN1
Potassium SCHEMBL7404680 0.78 KDM4E (0.61) IKBKBKDM4EALDH1A1GAAMEN1
Acrylic Acid SCHEMBL11829658 0.77 KDM4E (0.43) KDM4EALDH1A1KMT2AMAPTPARP1
SCHEMBL28320204 0.75 KDM4E (0.41) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL9343951 0.73 MAPT (0.47) IKBKBKDM4EALDH1A1GAAMEN1
SCHEMBL31030764 0.72 MEN1 (0.61) KDM4EALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
US-20200095358-A1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORPORATION (JP) 2020-03-26 US disclosed
EP-3553097-A1 COPOLYMER AND OPTICAL FILM USING SAME Tosoh Corporation (JP) 2019-10-16 EP disclosed