SCHEMBL19985037

SCHEMBL19985037

CCOC(=O)/C(=C/OC(O)C(C)=C(C)C)C1CCOc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.34
ALDH1A1 P00352 4/20 0.33
POLB P06746 3/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 4/20 0.33
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.33
AMY1A P0DUB6 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
NPSR1 Q6W5P4 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ITGAV P06756 1/20 0.32
ITGB6 P18564 1/20 0.32
PLIN1 O60240 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL19984935 0.90 GLS (0.35) ALDH1A1POLBMAPTSMN1; SMN2MAPK1
SCHEMBL23934559 0.83 PIN1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL19985045 0.81 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2AL3MBTL1
SCHEMBL19985049 0.81 MEN1 (0.40) SSTR4ALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL19984881 0.80 ANO1 (0.38) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL19984885 0.80 SIGMAR1 (0.34) ALDH1A1MAPTSMN1; SMN2GAAMEN1
SCHEMBL19985027 0.79 FFAR1 (0.38) GAAMEN1KMT2ANPSR1L3MBTL1
SCHEMBL19985035 0.78 MGAM (0.34) SSTR4ALDH1A1POLBMAPTMAPK1
SCHEMBL19984877 0.76 TSHR (0.37) ALDH1A1POLBMAPTSMN1; SMN2MAPK1
SCHEMBL19985052 0.76 NFE2L2 (0.35) SSTR4ALDH1A1POLBMAPTMAPK1

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-2018050477-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 WO disclosed