SCHEMBL10037355

SCHEMBL10037355

CC(=O)c1ccc(-c2sc(-c3ccc(-c4sc(-c5ccc(C(C)=O)cc5)c5c4C(=O)C(F)(F)C5=O)s3)c3c2C(=O)C(F)(F)C3=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.42
PTGS1 P23219 1/20 0.39
PRF1 P14222 1/20 0.38
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
HSD17B1 P14061 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK14 Q16539 1/20 0.35
NQO2 P16083 1/20 0.34
FBP1 P09467 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
BRD4 O60885 1/20 0.33
ALOX5 P09917 1/20 0.32
KIF11 P52732 1/20 0.32

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
SCHEMBL10037347 0.94 HDAC6 (0.48) HDAC6PTGS1PRF1PIK3CDPIK3CA
SCHEMBL10037356 0.84 HDAC6 (0.41) HDAC6
SCHEMBL10037350 0.80 LMNA (0.44) HDAC6MAPTL3MBTL1HPGDLMNA
SCHEMBL10037354 0.79 PTP4A3 (0.33) HDAC6HSD17B1MAPTNQO2L3MBTL1
SCHEMBL10037348 0.78 HDAC6 (0.47) HDAC6PRF1NQO2
SCHEMBL10037345 0.73 HSD17B1 (0.40) HDAC6HSD17B1NQO2HPGDRAB9A
SCHEMBL12973104 0.69 HDAC6 (0.62) HDAC6PRF1PIK3CDPIK3CAPIK3CB
SCHEMBL13620098 0.69 HDAC6 (0.37) HDAC6
SCHEMBL10037353 0.69
SCHEMBL10037351 0.69 HDAC6 (0.51) HDAC6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114956-B2 Polymer having unit obtained by condensation of difluorocyclopentanedione ring and aromatic ring, organic thin film using the same, and organic thin film device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-14 US disclosed
US-20100084640-A1 POLYMER HAVING UNIT OBTAINED BY CONDENSATION OF DIFLUOROCYCLOPENTANEDIONE RING AND AROMATIC RING, ORGANIC THIN FILM USING THE SAME, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
US-20100084640-A1 POLYMER HAVING UNIT OBTAINED BY CONDENSATION OF DIFLUOROCYCLOPENTANEDIONE RING AND AROMATIC RING, ORGANIC THIN FILM USING THE SAME, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed