SCHEMBL21457529

SCHEMBL21457529

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
NPSR1 Q6W5P4 4/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
USP2 O75604 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 2/20 0.41
ABCB11 O95342 1/20 0.41
LMNA P02545 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADRB3 P13945 1/20 0.41
CNR1 P21554 1/20 0.41
ACHE P22303 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2A P28223 1/20 0.41

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 0.87 KMT2A (0.44) MEN1KMT2AHPGDTDP1TSHR
SCHEMBL21457578 0.87 ALDH1A1 (0.39) MEN1KMT2ANPSR1MAPTHPGD
SCHEMBL21457597 0.87 CA1 (0.51) HPGDCYP3A4SMN1; SMN2ALDH1A1KDM4E
SCHEMBL6928918 0.85 HPGD (0.36) MEN1KMT2AHPGDCYP1A2CYP3A4
SCHEMBL21457545 0.85 GSK3B (0.45) MEN1KMT2AMAPTHPGDTDP1
SCHEMBL21457761 0.85 SMN1; SMN2 (0.42) MEN1KMT2AMAPTHPGDTDP1
SCHEMBL21457143 0.85 MAPT (0.40) MEN1KMT2ANPSR1MAPTHPGD
SCHEMBL21457176 0.85 SMN1; SMN2 (0.44) MEN1KMT2ANPSR1MAPTHPGD
SCHEMBL31467327 0.85 SMN1; SMN2 (0.44) MEN1KMT2ANPSR1MAPTHPGD
SCHEMBL21457601 0.84 NQO2 (0.50) MAPTHPGDCYP1A2CYP2C9CYP2C19

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