SCHEMBL28038726

SCHEMBL28038726

O=C(c1[c]cccc1)c1c(F)cccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.47
CES1 P23141 4/20 0.47
TDP1 Q9NUW8 2/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
BCHE P06276 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34

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
SCHEMBL9712664 0.81 CES2 (0.50) CES2CES1TDP1NPC1RAB9A
SCHEMBL143892 0.80 ALDH1A1 (0.38) CES2CES1TDP1KMT2AMEN1
SCHEMBL27653331 0.75 CES2 (0.70) CES2CES1TDP1LMNAKMT2A
SCHEMBL7525114 0.74 LTA4H (0.44) CES2CES1NPC1RAB9ALMNA
SCHEMBL1423982 0.74 RAB9A (0.46) NPC1RAB9ALMNAKMT2AMEN1
SCHEMBL1809 0.73
SCHEMBL6838156 0.73 GSTA1 (0.32) KMT2AMEN1
SCHEMBL218652 0.72 ALDH1A1 (0.54) CES2CES1TDP1NPC1RAB9A
SCHEMBL466291 0.71 KMT2A (0.41) LMNAKMT2AMEN1SMN1; SMN2CYP1A2
SCHEMBL1728206 0.71

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115646223-B Pollution-resistant polyethersulfone ultrafiltration membrane 安徽省海徽化工有限公司 2023-06-27 CN claimed
CN-115646223-A Stain-resistant polyethersulfone ultrafiltration membrane 安徽省海徽化工有限公司 2023-01-31 CN claimed
CN-115646223-B Pollution-resistant polyethersulfone ultrafiltration membrane 安徽省海徽化工有限公司 2023-06-27 CN disclosed
CN-115646223-A Stain-resistant polyethersulfone ultrafiltration membrane 安徽省海徽化工有限公司 2023-01-31 CN disclosed
CN-105037141-B Containing carboxyl double fluorine monomer, preparation method and its applications in carboxylic polyarylether is prepared 吉林大学 2017-08-01 CN disclosed
CN-105037141-A Carboxyl-containing difluoro monomer, preparation method of difluoro monomer and application of difluoro monomer to preparation of carboxyl-containing polyarylether UNIV JILIN 2015-11-11 CN disclosed