SCHEMBL21457700

SCHEMBL21457700

CC(C)OC(=O)/C(C#N)=C/c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
PTP4A3 O75365 2/20 0.52
PTP4A1 Q93096 2/20 0.52
PTP4A2 Q12974 1/20 0.52
DNM1 Q05193 3/20 0.51
EGFR P00533 4/20 0.50
MAPT P10636 6/20 0.48
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
TDP1 Q9NUW8 4/20 0.46
KDM4E B2RXH2 3/20 0.46
TP53 P04637 3/20 0.46
CYP1A2 P05177 3/20 0.46
HSD17B10 Q99714 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ERBB2 P04626 3/20 0.46
RGS12 O14924 2/20 0.46
GMNN O75496 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46

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
SCHEMBL21457703 1.00 ALDH1A1 (0.53) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL21457260 0.90 ALDH1A1 (0.53) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL21457263 0.90 ALDH1A1 (0.53) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL21457603 0.90 ALDH1A1 (0.55) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL21457606 0.90 ALDH1A1 (0.55) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL9347047 0.87 DNM1 (0.67) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL9347040 0.87 DNM1 (0.67) ALDH1A1PTP4A3PTP4A1PTP4A2DNM1
SCHEMBL21457243 0.86 DNM1 (0.54) ALDH1A1DNM1EGFRMAPTKMT2A
SCHEMBL131205 0.86 DNM1 (0.54) ALDH1A1DNM1EGFRMAPTKMT2A
SCHEMBL21457570 0.84 DNM1 (0.57) ALDH1A1PTP4A3PTP4A1DNM1EGFR

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 5 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
CN-110248971-B Copolymer and optical film using the same 东曹株式会社 2021-11-02 CN 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