SCHEMBL17599779

SCHEMBL17599779

CCCCC(CC)C(=O)OCCOc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
XBP1 P17861 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARG P37231 8/20 0.41
PTGES O14684 7/20 0.41
ALOX5 P09917 7/20 0.41
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CNR2 P34972 1/20 0.39
SMPD1 P17405 1/20 0.39
ADORA1 P30542 2/20 0.38
ADORA2A P29274 1/20 0.38
PTPN11 Q06124 1/20 0.37
TSHR P16473 1/20 0.37
GUSB P08236 1/20 0.37
PPARA Q07869 1/20 0.36

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
SCHEMBL19502238 0.85 ALOX5 (0.49) NPSR1L3MBTL1PPARGPTGESALOX5
SCHEMBL29069614 0.85 PTGES (0.41) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL19240505 0.84 PTGES (0.44) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2608670 0.83 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL29370811 0.83 PPARG (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL16415394 0.82 BCHE (0.53) NPSR1L3MBTL1BCHEACHEESR1
SCHEMBL28471470 0.81 BCHE (0.40) NPSR1BCHEACHEESR1ESR2
SCHEMBL676845 0.80 SMPD1 (0.51) NPSR1BCHEACHEESR1ESR2
SCHEMBL30031555 0.80 LMNA (0.49) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL5047989 0.80 PPARG (0.41) GAAXBP1ATMNPSR1L3MBTL1

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
CN-109477922-B Resin composition for polarizer protective film, and polarizer protective film 电化株式会社 2021-10-08 CN disclosed
EP-3632968-B1 VINYLIDENE-FLUORIDE RESIN FILM DENKA COMPANY LTD (JP) 2021-07-07 EP disclosed
EP-2998359-A1 MOLDED ARTICLE, INSULATING MATERIAL COMPRISING SAME, AND METHOD FOR IMPROVING ELECTRICAL-INSULATING PROPERTY OF POLYESTER RESIN COMPOSITION Adeka Corporation (JP) 2016-03-23 EP disclosed