SCHEMBL5792773

SCHEMBL5792773

CCCCOC(=O)C(CCCC)C(=O)OO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
ATM Q13315 2/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 4/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 5/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
NAAA Q02083 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
EPHX1 P07099 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 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
SCHEMBL2276735 0.92 ALDH1A1 (0.54) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL3229506 0.90 CA2 (0.47) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL28651223 0.88 ALDH1A1 (0.50) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL11874453 0.86 MEN1 (0.56) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL28123196 0.86 ALDH1A1 (0.52) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL28670414 0.86 NAAA (0.52) ALDH1A1ATMTSHRCA1CA2
SCHEMBL10444863 0.85 CA1 (0.53) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL28650937 0.84 ALDH1A1 (0.50) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL7633731 0.84 ALDH1A1 (0.50) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL28911896 0.84 ALDH1A1 (0.50) ALDH1A1ATMMEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006011647-A1 POLYMERIZABLE COMPOSITION, OPTICALLY ANISOTROPIC LAYER AND METHOD FOR MANUFACTURING THEREOF, OPTICAL COMPENSATORY ELEMENT, LIQUID CRYSTAL DISPLAY AND LIQUID CRYSTAL PROJECTOR FUJIFILM CORPORATION (JP) 2006-02-02 WO disclosed