SCHEMBL85794

SCHEMBL85794

C=CC(=O)OC(C)(c1ccco1)C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
SRC P12931 1/20 0.39
ALDH1A1 P00352 5/20 0.33
POLB P06746 4/20 0.33
KDM4E B2RXH2 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 3/20 0.32
ADORA2B P29275 1/20 0.32
CHRM3 P20309 3/20 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
SCHEMBL75375 0.85 SRC (0.41) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL10040353 0.84 SRC (0.40) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL74952 0.78 MAPT (0.47) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL75369 0.75 MAPT (0.35) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL16942536 0.74 ALDH1A1 (0.35) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL74976 0.74 ALDH1A1 (0.35) MAPTSRCALDH1A1POLBKDM4E
SCHEMBL16338051 0.72 THRA (0.33)
SCHEMBL74549 0.71 MAPT (0.44) MAPTSRCALDH1A1POLBL3MBTL1
SCHEMBL14825628 0.71 MAPT (0.33) MAPTALDH1A1POLBKDM4EL3MBTL1
SCHEMBL5004300 0.71 EPHX1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129099-B2 Double patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-06 US disclosed
US-20090208886-A1 DOUBLE PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-08-20 US disclosed