SCHEMBL28291416

SCHEMBL28291416

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

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
TSHR P16473 2/20 0.32
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HTT P42858 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
SCHEMBL25981443 0.82 TSHR (0.33) TSHRTDP1HTT
SCHEMBL1147112 0.82 TSHR (0.33) TSHRTDP1
SCHEMBL28291415 0.81 TP53 (0.32) TP53TSHR
SCHEMBL6215006 0.79 TSHR (0.50) TP53TSHRMAPTTDP1MEN1
SCHEMBL24414476 0.79 MAPT (0.47) TP53TSHRMAPTTDP1MEN1
SCHEMBL24414470 0.79 MAPT (0.47) TP53TSHRMAPTTDP1MEN1
SCHEMBL24414506 0.79 MAPT (0.47) TP53TSHRMAPTTDP1MEN1
SCHEMBL447235 0.79 MAPT (0.47) TP53TSHRMAPTTDP1MEN1
SCHEMBL767015 0.79 TSHR (0.50) TP53TSHRMAPTTDP1MEN1
SCHEMBL24414542 0.79 MAPT (0.47) TP53TSHRMAPTTDP1MEN1

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
CN-109627165-A A kind of method of coproduction 2- fluorine propionic ester and ethyl difluoro 浙江巨化技术中心有限公司 2019-04-16 CN claimed
CN-109627165-A A kind of method of coproduction 2- fluorine propionic ester and ethyl difluoro 浙江巨化技术中心有限公司 2019-04-16 CN disclosed