SCHEMBL4580895

SCHEMBL4580895

C=C(C)C(=O)OCc1ccccc1.C=C(CC=C(C)C(=O)O)C(=O)OCCO.C=CCOC(=O)C(=C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
CYP3A4 P08684 1/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
HCAR2 Q8TDS4 1/20 0.31
MAPT P10636 2/20 0.31
FAAH O00519 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MAPK1 P28482 2/20 0.30
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SLC6A2 P23975 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
SCHEMBL1855787 0.94 ALDH1A1 (0.40) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1
SCHEMBL195082 0.94 ALDH1A1 (0.40) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1
SCHEMBL7161135 0.94 ALDH1A1 (0.40) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1
SCHEMBL967571 0.94 ALDH1A1 (0.40) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1
SCHEMBL2946643 0.90 ALDH1A1 (0.37) ALDH1A1LMNASMN1; SMN2TDP1POLB
SCHEMBL189711 0.84 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2TDP1HTT
SCHEMBL8942785 0.83 TSHR (0.47) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1
SCHEMBL1228085 0.82 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2TDP1HTT
SCHEMBL2097594 0.82 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2TDP1HTT
SCHEMBL16651566 0.82 TSHR (0.50) ALDH1A1CYP3A4LMNASMN1; SMN2TDP1

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-7323232-B2 Resin composition for spacer, spacer, and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-01-29 US disclosed
US-20040086663-A1 Resin composition for spacer, spacer, and liquid crystal display device FUJI PHOTO FILM CO., LTD. 2004-05-06 US disclosed