SCHEMBL29050451

SCHEMBL29050451

CCC(=O)OCC(F)F.O=C(O)CCC(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 3/20 0.36
KDM4A O75164 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM2A Q9Y2K7 2/20 0.36
TET3 O43151 1/20 0.36
GABRP O00591 2/20 0.35
GABRD O14764 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRB1 P18505 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA2 P47869 2/20 0.35
GABRB2 P47870 2/20 0.35
GABRA4 P48169 2/20 0.35
GABRE P78334 2/20 0.35
GABRA6 Q16445 2/20 0.35
GABRG1 Q8N1C3 2/20 0.35
GABRG3 Q99928 2/20 0.35

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
SCHEMBL973850 0.84
SCHEMBL30267404 0.81 TDP1 (0.40) TET2KDM4AKDM4CKDM2ATET3
SCHEMBL14482078 0.78 NOTUM (0.40) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL12019084 0.77 NOTUM (0.42) KDM2ATSHRCYP3A4ATMTDP1
SCHEMBL1032360 0.76
SCHEMBL3503949 0.75 CYP3A4 (0.41) TET2KDM4AKDM4CKDM2ATET3
Hydrochloric Acid SCHEMBL7410571 0.73
SCHEMBL12019107 0.72 ALDH1A1 (0.48) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL15537280 0.72 NAAA (0.48) CYP1A2NAAAALDH1A1
SCHEMBL3502761 0.71 FFAR4 (0.49) TSHRMAPTLMNA

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-113782834-B Electrolyte containing phenyl sulfonate compound and lithium ion battery 九江天赐高新材料有限公司 2022-11-15 CN claimed
CN-113782834-B Electrolyte containing phenyl sulfonate compound and lithium ion battery 九江天赐高新材料有限公司 2022-11-15 CN disclosed