SCHEMBL28633532

SCHEMBL28633532

CCCOC(=O)CC(F)(F)Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.36
DGKA P23743 1/20 0.36
ALDH1A1 P00352 5/20 0.36
HCAR2 Q8TDS4 1/20 0.35
LMNA P02545 1/20 0.33
CES2 O00748 1/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RAB9A P51151 1/20 0.31
FAAH O00519 1/20 0.31
DNM1 Q05193 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
SCHEMBL5748555 0.83 GAA (0.48) ALDH1A1LMNARAB9A
SCHEMBL123715 0.83 NAAA (0.39) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL28366036 0.83 NAAA (0.39) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL27607203 0.78 NAAA (0.35) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL15876208 0.76 NAAA (0.40) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL5011564 0.76 RAB9A (0.44) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL9247625 0.74 HCAR2 (0.38) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL31058603 0.74 NAAA (0.39) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL17521644 0.73 NAAA (0.35) NAAADGKAALDH1A1HCAR2LMNA
SCHEMBL27782247 0.72 NAAA (0.38) NAAADGKAALDH1A1HCAR2LMNA

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
CN-108794334-B Method for preparing difluoroacetic acid ester through gas-solid phase reaction 浙江省化工研究院有限公司 2021-05-11 CN disclosed