SCHEMBL21457598

SCHEMBL21457598

COc1ccc(C=C(C#N)C(=O)OC(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.59
PTP4A3 O75365 1/20 0.57
PTP4A2 Q12974 1/20 0.57
PTP4A1 Q93096 1/20 0.57
KDM4E B2RXH2 8/20 0.56
HPGD P15428 6/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 2/20 0.54
MAPT P10636 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
TSHR P16473 1/20 0.54
NFKB1 P19838 1/20 0.54
APEX1 P27695 1/20 0.54
BLM P54132 1/20 0.54
PMP22 Q01453 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
GAA P10253 2/20 0.52

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
SCHEMBL21457595 1.00 ALDH1A1 (0.59) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457547 0.86 ALDH1A1 (0.56) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457546 0.86 ALDH1A1 (0.56) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457576 0.85 ALDH1A1 (0.61) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457594 0.85 ALDH1A1 (0.61) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457572 0.85 ALDH1A1 (0.61) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL21457591 0.85 ALDH1A1 (0.61) ALDH1A1PTP4A3PTP4A2PTP4A1KDM4E
SCHEMBL5181260 0.85 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL21457679 0.85 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL5181255 0.85 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMEN1KMT2A

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