SCHEMBL21457366

SCHEMBL21457366

Cc1cccc(C(C#N)=CC(=O)OC(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
ELANE P08246 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
KCNK3 O14649 4/20 0.39
KCNK9 Q9NPC2 4/20 0.39
KCNH2 Q12809 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL21457690 0.86 MAPK1 (0.40) PARP1KDM4EALDH1A1RAB9A
SCHEMBL21457275 0.86 AKR1C3 (0.39) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL21457641 0.85 GSK3B (0.50) ALDH1A1P2RY2GPR17
SCHEMBL21457621 0.85 PTPN7 (0.43) PARP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL21457430 0.85 SMN1; SMN2 (0.41) PARP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL21457488 0.85 ALDH1A1 (0.45) PARP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL21457295 0.85 CES2 (0.49) PARP1ELANEKDM4EMEN1ALDH1A1
SCHEMBL21457347 0.85 HDAC8 (0.45) PARP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL21457176 0.84 SMN1; SMN2 (0.44) KDM4EMEN1ALDH1A1LMNACYP1A2
SCHEMBL31467327 0.84 SMN1; SMN2 (0.44) KDM4EMEN1ALDH1A1LMNACYP1A2

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