SCHEMBL28545950

SCHEMBL28545950

C=CCC(CCCCC)OC(=O)C(F)(F)Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
FAAH O00519 12/20 0.34
CES1 P23141 6/20 0.33
CES2 O00748 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 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
SCHEMBL28539070 0.86 ZDHHC7 (0.36) TSHRFAAHCES1CES2MAPT
SCHEMBL14456650 0.83
SCHEMBL31216707 0.82 TSHR (0.41) TSHRFAAHMAPTZDHHC7MAPK1
SCHEMBL11617657 0.79 PRKCA (0.45) TSHRFAAHMAPTMAPK1LMNA
SCHEMBL4603438 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1
SCHEMBL31216700 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1
SCHEMBL31216704 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1
SCHEMBL31216717 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1
SCHEMBL31216699 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1
SCHEMBL17627885 0.77 PRKCA (0.48) TSHRFAAHMAPTMAPK1ALDH1A1

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 3 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
CN-112592270-A Preparation method of 2-halogenated-2, 2-difluoroacetic acid alkenyl ester 杭州传化精细化工有限公司 2021-04-02 CN disclosed