SCHEMBL3751876

SCHEMBL3751876

CC(C)(O)CC(=O)CCCCCO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.44
GPR84 Q9NQS5 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 2/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 2/20 0.33
CAMK2A Q9UQM7 1/20 0.32
HAO1 Q9UJM8 1/20 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
SCHEMBL2526451 0.84 FFAR1 (0.46) FFAR1GPR84FFAR4KDM4ESMN1; SMN2
SCHEMBL2529087 0.84 FFAR1 (0.46) FFAR1GPR84FFAR4KDM4ESMN1; SMN2
SCHEMBL2528979 0.82 GPR84 (0.42) FFAR1GPR84FFAR4KDM4ESMN1; SMN2
SCHEMBL11057425 0.81 HMGCR (0.36) ALDH1A1TSHRPIK3CD
SCHEMBL96402 0.80 KMT2A (0.50) FFAR1GPR84FFAR4TDP1KMT2A
SCHEMBL28629329 0.78 PIK3CD (0.31) KMT2AMAPTPIK3CD
SCHEMBL9431941 0.77 CES1 (0.46) KMT2AMAPTALDH1A1HAO1
SCHEMBL7581690 0.76
SCHEMBL25432514 0.75 GPR84 (0.63) FFAR1GPR84FFAR4KDM4ESMN1; SMN2
SCHEMBL19066840 0.75 GPR84 (0.63) FFAR1GPR84FFAR4KDM4ESMN1; SMN2

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-20100302489-A1 LIQUID CRYSTAL LAYER FORMING INK COMPOSITION, AND OPTICAL FILM, POLARIZING FILM AND LIQUID CRYSTAL DISPLAY PRODUCED WITH THE INK COMPOSITION DAI NIPPON PRINTING CO., LTD. (JP) 2010-12-02 US disclosed
US-20090033834-A1 LIQUID CRYSTAL LAYER FORMING INK COMPOSITION, AND OPTICAL FILM, POLARIZING FILM AND LIQUID CRYSTAL DISPLAY PRODUCED WITH THE INK COMPOSITION DAI NIPPON PRINTING CO., LTD. (JP) 2009-02-05 US disclosed