SCHEMBL6843791

SCHEMBL6843791

O=C(O)C(Cc1c[nH]c2ccccc12)N(F)F

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.65
KDM4E B2RXH2 3/20 0.63
MAPT P10636 3/20 0.63
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.63
POLB P06746 2/20 0.63
APAF1 O14727 1/20 0.63
RECQL P46063 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
LMNA P02545 1/20 0.63
MPO P05164 1/20 0.63
TSHR P16473 1/20 0.63
BLM P54132 1/20 0.63
PMP22 Q01453 1/20 0.63
HIF1A Q16665 1/20 0.63
DNMT1 P26358 3/20 0.55
CYP2C19 P33261 1/20 0.54
DNMT3B Q9UBC3 1/20 0.54
PKM P14618 1/20 0.54
ALOX15 P16050 1/20 0.53

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
SCHEMBL6843792 1.00 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL31414630 0.90 SMN1; SMN2 (0.63) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL28163928 0.89 KDM4E (0.64) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL29457735 0.89 SMN1; SMN2 (0.66) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL828693 0.87 SMN1; SMN2 (0.67) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL828692 0.87 SMN1; SMN2 (0.67) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL3855611 0.86 KDM4E (0.68) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL3380280 0.86 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL1162356 0.86 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTKMT2AMEN1
SCHEMBL1162357 0.86 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTKMT2AMEN1

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
US-20040259256-A1 Methods of unnatural amino acid incorporation in mammalian cells NEURION PHARMACEUTICALS 2004-12-23 US disclosed
WO-2004085463-A2 METHODS OF UNNATURAL AMINO ACID INCORPORATION IN PROTEINS IN MAMMALIAN CELLS NEURION PHARMACEUTICALS (US) 2004-10-07 WO disclosed