SCHEMBL30396396

SCHEMBL30396396

Nc1ccc(-c2ccccc2OC(F)(F)F)c(OC(F)(F)F)c1N

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 4/20 0.42
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HSD11B1 P28845 1/20 0.38
MPL P40238 1/20 0.38
KCNN4 O15554 1/20 0.36
SCN9A Q15858 4/20 0.36
SCN5A Q14524 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TRPA1 O75762 1/20 0.36
S1PR1 P21453 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL4379377 0.81 MPL (0.43) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL398120 0.79 ALDH1A1 (0.52) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL7701143 0.78 ALDH1A1 (0.50) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL9681949 0.78 SCN10A (0.32) SCN10A
SCHEMBL14743948 0.75 MPL (0.42) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL14747086 0.75 BTK (0.43) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL31533745 0.73 GPR3 (0.35) POLBKDM4EMAPT
SCHEMBL14744548 0.72 MPL (0.41) SCN10AALOX5APFEN1ALDH1A1L3MBTL1
SCHEMBL28621084 0.71 ALDH1A1 (0.48) ALDH1A1POLBNPSR1KDM4EMAPT
SCHEMBL2848722 0.71 MPL (0.41) ALOX5APFEN1ALDH1A1MPLSCN9A

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-115960380-A Polyimide composite membrane and preparation method and application thereof 中国石油化工股份有限公司 2023-04-14 CN disclosed