SCHEMBL19984877

SCHEMBL19984877

CCOC(=O)/C(=C/OC(O)C=C(C)C)C1COc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GLS O94925 2/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.34
CASP3 P42574 2/20 0.34
CASP7 P55210 1/20 0.34
CASP8 Q14790 1/20 0.34
ACKR3 P25106 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 2/20 0.34
MGAM O43451 1/20 0.34
AMY1A P0DUB6 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
TP53 P04637 1/20 0.34

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 0.86 GLS (0.35) TSHRNPSR1L3MBTL1GLSALDH1A1
SCHEMBL19985047 0.80 PIN1 (0.38) L3MBTL1ACKR3MEN1KMT2A
SCHEMBL21538741 0.80 GLS (0.41) TSHRNPSR1L3MBTL1GLSALDH1A1
SCHEMBL19984919 0.79 PRMT5 (0.38) TSHRALDH1A1MEN1KMT2ATP53
SCHEMBL19985041 0.78 ANO1 (0.38) ALDH1A1MEN1KMT2AKDM4EPSMB5
SCHEMBL19984893 0.77 SIGMAR1 (0.32) L3MBTL1ALDH1A1SMN1; SMN2CASP3MEN1
SCHEMBL19984934 0.77 TSHR (0.36) TSHRNPSR1L3MBTL1GLSALDH1A1
SCHEMBL19984900 0.77 FFAR1 (0.38) NPSR1L3MBTL1MEN1KMT2AGAA
SCHEMBL19985037 0.76 SSTR4 (0.34) TSHRNPSR1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL19984986 0.75 LTB4R (0.32)

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