SCHEMBL5000748

SCHEMBL5000748

CCC12CC3CC(C(=O)O)(C1)CC(C14CC5CC(CC)(CC(C(=O)O)(C5)C1)C4)(C3)C2

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
PKM P14618 2/20 0.43
GRIN2D O15399 3/20 0.41
GRIN3B O60391 3/20 0.41
GRIN1 Q05586 3/20 0.41
GRIN2A Q12879 3/20 0.41
GRIN2B Q13224 3/20 0.41
GRIN2C Q14957 3/20 0.41
GRIN3A Q8TCU5 3/20 0.41
ALOX15 P16050 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.33
HSD11B1 P28845 1/20 0.32
P2RX7 Q99572 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL9402854 0.90 ALDH1A1 (0.49) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL962559 0.82 ALDH1A1 (0.43) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL301313 0.81 ALDH1A1 (0.42) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL301686 0.77 ALDH1A1 (0.64) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL5004369 0.74 ALDH1A1 (0.33) ALDH1A1PKM
SCHEMBL23457528 0.74 GRIN2D (0.62) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL23457591 0.74 GRIN2D (0.62) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL23489293 0.74 GRIN2D (0.62) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL19149468 0.74 GRIN2D (0.62) ALDH1A1PKMGRIN2DGRIN3BGRIN1
SCHEMBL23489295 0.74 GRIN2D (0.62) ALDH1A1PKMGRIN2DGRIN3BGRIN1

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-8337982-B2 Comprising first repeating unit obtained by reaction of bisaminophenol compound and dicarboxylic acid, at least one of which has diamondoid structure and second repeating unit obtained by reaction of bisaminophenol compound having no diamondoid structure and dicarboxylic acid; heat resistance SUMITOMO BAKELITE CO., LTD. (JP) 2012-12-25 US disclosed
US-20080206548-A1 Benzoxazole Resin Precursor, Polybenzoxazole Resin, Resin Film And Semiconductor Device SUMITOMO BAKELITE CO., LTD (JP) 2008-08-28 US disclosed
EP-1832619-A1 BENZOXAZOLE RESIN PRECURSOR, POLYBENZOXAZOLE RESIN, RESIN FILM, AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Company, Limited (JP) 2007-09-12 EP disclosed