SCHEMBL2855181

SCHEMBL2855181

O=C(O)C1C(C(=O)O)C(C(=O)O)(C2CC2)C1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GMNN O75496 1/20 0.34
LMNA P02545 1/20 0.34
PMP22 Q01453 1/20 0.34
TFPI2 P48307 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
THPO P40225 1/20 0.34
GRM2 Q14416 7/20 0.34
GRM6 O15303 5/20 0.34
GRM3 Q14832 4/20 0.34
GRM8 O00222 3/20 0.34
GRM1 Q13255 3/20 0.33
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
GRM5 P41594 4/20 0.31

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
SCHEMBL27829935 0.91 GRM8 (0.32) POLBAPEX1TDP1KDM4EGMNN
SCHEMBL5453760 0.64 KDM4E (0.35) TDP1KDM4ETP53TSHRGRM2
SCHEMBL1286184 0.64 TDP1 (0.35) POLBTDP1GMNNLMNAPMP22
SCHEMBL3480615 0.64 GRM2 (0.45) GRM2GRM6GRM3GRM8GRM1
SCHEMBL5428847 0.62 MAPK1 (0.42) GMNNLMNAPMP22TP53NFKB1
SCHEMBL19475140 0.61 MAPK1 (0.33) GMNNLMNAPMP22TP53NFKB1
SCHEMBL206269 0.61 CYP2C19 (0.35) TDP1KDM4EGMNNLMNAPMP22
SCHEMBL31076270 0.61 SLC1A2 (0.32) TDP1KDM4ELMNAPMP22TSHR
SCHEMBL1664043 0.57 POLB (0.48) POLBAPEX1TDP1KDM4EGMNN
SCHEMBL16909909 0.57 POLB (0.48) POLBAPEX1TDP1KDM4EGMNN

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-20100040806-A1 CELLULOSE ESTER OPTICAL FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY USING THE CELLULOSE ESTER OPTICAL FILM, AND METHOD FOR PRODUCING CELLULOSE ESTER OPTICAL FILM KONICA MINOLTA OPTO, INC. (JP) 2010-02-18 US disclosed
US-20080057227-A1 Manufacturing method of cellulose acylate film, cellulose acylate film, polarizing plate and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2008-03-06 US disclosed