SCHEMBL21457597

SCHEMBL21457597

CC(C)OC(=O)C=C(C#N)c1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.51
CA2 P00918 8/20 0.51
CA12 O43570 7/20 0.51
CA7 P43166 7/20 0.51
CA9 Q16790 7/20 0.51
CA14 Q9ULX7 7/20 0.51
AKR1B10 O60218 1/20 0.49
AKR1B1 P15121 1/20 0.49
NQO2 P16083 1/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
HPGD P15428 2/20 0.36
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
CISD1 Q9NZ45 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SLC16A3 O15427 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL21457287 0.88 KMT2A (0.44) CA1CA2CA12CA7CA9
SCHEMBL21457578 0.88 ALDH1A1 (0.39) CA1CA2CA12CA7CA9
SCHEMBL6928918 0.87 HPGD (0.36) CA1CA2CA12CA7CA9
SCHEMBL21457761 0.87 SMN1; SMN2 (0.42) CA1CA2CA12CA7CA9
SCHEMBL21457143 0.87 MAPT (0.40) CA1CA2CA12CA7CA9
SCHEMBL21457529 0.87 MEN1 (0.41) CA1CA2CA12CA7CA9
SCHEMBL21457545 0.87 GSK3B (0.45) CA1CA2CA12CA7CA9
SCHEMBL21457176 0.86 SMN1; SMN2 (0.44) HPGDALDH1A1SMN1; SMN2PDCD1CD274
SCHEMBL31467327 0.86 SMN1; SMN2 (0.44) HPGDALDH1A1SMN1; SMN2PDCD1CD274
SCHEMBL21457601 0.85 NQO2 (0.50) CA1CA2NQO2HPGDALDH1A1

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