SCHEMBL28540645

SCHEMBL28540645

C=CCC(CCC)OC(=O)C(F)(F)Br

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PRKCA P17252 1/20 0.31
PRKCD Q05655 1/20 0.31

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
SCHEMBL28539070 0.90 ZDHHC7 (0.36) MEN1KMT2A
SCHEMBL29091396 0.86 CTSK (0.32) CTSKMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL20455854 0.85 CTSK (0.37) CTSKPRKCAPRKCD
SCHEMBL29287648 0.78 CTSK (0.37) CTSKALDH1A1PRKCAPRKCD
SCHEMBL7738388 0.76 CTSK (0.36) CTSKALDH1A1PRKCAPRKCD
SCHEMBL28545950 0.75 TSHR (0.36) MEN1ALDH1A1KMT2A
SCHEMBL14456650 0.71
SCHEMBL31216707 0.71 TSHR (0.41) ALDH1A1PRKCA
SCHEMBL4349371 0.69
SCHEMBL17464286 0.69 TSHR (0.38) CTSKALDH1A1

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-112608414-B Fluorine-containing copolymer emulsion and preparation method and application thereof 杭州传化精细化工有限公司 2022-09-06 CN disclosed
CN-112608414-A Fluorine-containing copolymer emulsion and preparation method and application thereof 杭州传化精细化工有限公司 2021-04-06 CN disclosed