SCHEMBL2467984

SCHEMBL2467984

C=CC(=O)OCC(O)CCCCCCCCC(O)COC(=O)C=C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
ALDH1A1 P00352 6/20 0.52
CYP3A4 P08684 5/20 0.52
USP2 O75604 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
HPGD P15428 2/20 0.49
TP53 P04637 4/20 0.42
HIF1A Q16665 3/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GPR84 Q9NQS5 4/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
THRB P10828 2/20 0.33
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33

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
SCHEMBL28586094 0.93 TSHR (0.47) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL10557592 0.93 TSHR (0.47) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL304613 0.93 ALDH1A1 (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL28391988 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL2779816 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL11161790 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL5682742 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL2780791 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL2989728 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; SMN2
SCHEMBL27897426 0.91 TSHR (0.59) TSHRALDH1A1CYP3A4USP2SMN1; 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
EP-2371910-A9 Ink composition, inkjet recording method and process for producing molded printed material Fujifilm Corporation (JP) 2012-07-11 EP disclosed
EP-2371910-A1 Ink composition, inkjet recording method and process for producing molded printed material Fujifilm Corporation (JP) 2011-10-05 EP disclosed