SCHEMBL9700923

SCHEMBL9700923

CC(C)=C(C)C(=O)OCC(F)(F)C(F)F

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 4/20 0.38
NPSR1 Q6W5P4 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.33
HTT P42858 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
SCHEMBL24305750 0.84 POLB (0.41) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL227643 0.81 TSHR (0.47) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL13522440 0.80 TSHR (0.37) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL19796057 0.79 HTT (0.46) ALDH1A1MEN1KMT2ATSHRHTT
SCHEMBL2536484 0.79 POLB (0.43) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL9821068 0.77 TSHR (0.43) POLBGAAALDH1A1NPSR1MEN1
Methacrylic Acid SCHEMBL28209124 0.77 TSHR (0.43) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL25981449 0.75 POLB (0.43) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL308634 0.74 TSHR (0.41) POLBGAAALDH1A1NPSR1MEN1
SCHEMBL2526807 0.74 TSHR (0.37) POLBGAAALDH1A1NPSR1MEN1

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
US-5155793-A OPTICAL COMPONENT FOR APPLICATIONS IN INTEGRATED OPTICS THOMSON-CSF (FR) 1992-10-13 US disclosed