SCHEMBL21457542

SCHEMBL21457542

C=CNC(=O)c1cccc2cccc(C(N)=O)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 11/20 0.44
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
PDPK1 O15530 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
PLK4 O00444 1/20 0.37
CHEK1 O14757 1/20 0.37
AURKA O14965 1/20 0.37
DAPK3 O43293 1/20 0.37
MAP4K4 O95819 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 1/20 0.37
FGFR1 P11362 1/20 0.37
PDGFRA P16234 1/20 0.37
LTK P29376 1/20 0.37
KDR P35968 1/20 0.37
MAP2K2 P36507 1/20 0.37
FLT3 P36888 1/20 0.37

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
SCHEMBL225451 0.81 KDM4E (0.45) PARP1KDM4EALDH1A1GAASMN1; SMN2
SCHEMBL157601 0.80 KDM4E (0.55) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL7949001 0.80 MMP3 (0.55) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL30578752 0.80 MMP3 (0.55) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL21457763 0.79 IKBKB (0.46) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL14837758 0.78 KDM4E (0.53) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL11872644 0.78 PLK4 (0.44) PARP1KDM4EALDH1A1GAAPDPK1
Acrylic Acid SCHEMBL11829658 0.75 KDM4E (0.43) PARP1KDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL27530857 0.74 PARP1 (0.37) PARP1KDM4EALDH1A1GAAPDPK1
SCHEMBL1353024 0.73 HSD17B10 (0.64) PARP1KDM4EALDH1A1GAAPDPK1

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 4 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
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