SCHEMBL28935348

SCHEMBL28935348

Fc1ccc(F)c(OCC(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 2/20 0.47
USP2 O75604 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
THRB P10828 1/20 0.47
G6PD P11413 1/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MRGPRX1 Q96LB2 2/20 0.40
ALOX5AP P20292 1/20 0.39

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
SCHEMBL6744768 0.82 SSTR4 (0.36) L3MBTL1HTT
SCHEMBL12598685 0.81 FFAR1 (0.46) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL3295756 0.81 FFAR1 (0.46) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL7821233 0.81 ALDH1A1 (0.63) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL12269202 0.81 ALDH1A1 (0.44) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL29408103 0.81 UGCG (0.39)
SCHEMBL29865474 0.81 MAPT (0.53) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL68550 0.81 ALDH1A1 (0.44) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL29470092 0.81 ALDH1A1 (0.56) MAPTMEN1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL7836750 0.79 ALDH1A1 (0.61) MAPTMEN1KMT2AALDH1A1KDM4E

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-114163312-A Synthetic method of fluorine-containing p-phenylene diether compound 张家港市国泰华荣化工新材料有限公司 2022-03-11 CN disclosed