SCHEMBL28865845

SCHEMBL28865845

N#Cc1ccc(CP(=O)(O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 3/20 0.49
PTPN1 P18031 3/20 0.49
PTPN4 P29074 3/20 0.49
PTPN9 P43378 3/20 0.49
PTPN11 Q06124 3/20 0.49
CFTR P13569 1/20 0.48
MAPT P10636 1/20 0.45
MMP2 P08253 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
TMEM97 Q5BJF2 1/20 0.43
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.42
SAE1 Q9UBE0 1/20 0.41
UBA2 Q9UBT2 1/20 0.41
HTT P42858 1/20 0.41
SNCA P37840 1/20 0.41
MAOB P27338 1/20 0.41
CRHBP P24387 1/20 0.41

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
SCHEMBL29201710 0.86 CFTR (0.64) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL29119901 0.83 CYP3A4 (0.53) MAPTMEN1NPC1KMT2ATSHR
SCHEMBL6448091 0.82 CFTR (0.64) PTPN2PTPN1PTPN4PTPN9PTPN11
SCHEMBL25295182 0.79 TSHR (0.48) MAPTMEN1NPC1KMT2ATSHR
SCHEMBL9138733 0.78 MMP2 (0.52) MMP2SAE1UBA2HTTCTBP2
SCHEMBL14287841 0.76 CFTR (0.52) PTPN2PTPN1PTPN4PTPN9PTPN11
Benzonitrile SCHEMBL28123533 0.73 TSHR (0.70) MAPTMMP2MEN1NPC1KMT2A
SCHEMBL28499490 0.72 TSHR (0.54) MAPTMMP2MEN1NPC1KMT2A
SCHEMBL29732960 0.72 TSHR (0.54) MAPTMMP2MEN1NPC1KMT2A
SCHEMBL18614123 0.72 TSHR (0.54) MAPTMMP2MEN1NPC1KMT2A

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-115073519-A High-low temperature resistant flame retardant for polyester, preparation method and application thereof 寿光卫东化工有限公司 2022-09-20 CN claimed
CN-115073519-A High-low temperature resistant flame retardant for polyester, preparation method and application thereof 寿光卫东化工有限公司 2022-09-20 CN disclosed