SCHEMBL21457530

SCHEMBL21457530

CC(C)COC(=O)C(C#N)=Cc1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.50
ALDH1A1 P00352 7/20 0.49
MAPT P10636 6/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
PKM P14618 1/20 0.49
HTT P42858 1/20 0.49
KDM4E B2RXH2 2/20 0.47
THRB P10828 1/20 0.47
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
TP53 P04637 1/20 0.46
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTP4A3 O75365 1/20 0.44
PTP4A1 Q93096 1/20 0.44

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
SCHEMBL21457527 1.00 DNM1 (0.50) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457570 0.91 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457568 0.91 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457695 0.91 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457692 0.91 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457669 0.86 ALDH1A1 (0.65) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457667 0.86 ALDH1A1 (0.65) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457131 0.84 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457133 0.84 DNM1 (0.57) DNM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL21457617 0.84 TDP1 (0.53) DNM1ALDH1A1MAPTMEN1KMT2A

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