SCHEMBL14219642

SCHEMBL14219642

Cc1cnc(Nc2c(C(=O)NOC(C)(C)C)cc(F)c(F)c2F)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DHODH Q02127 2/20 0.36
PTGS2 P35354 1/20 0.35
LCK P06239 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
MAP2K1 Q02750 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EGFR P00533 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
SCN9A Q15858 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL14219649 0.89 TDP1 (0.38) TDP1MEN1KMT2APTGS2MAP2K1
SCHEMBL14220115 0.89 TDP1 (0.38) TDP1MEN1KMT2APTGS2MAP2K1
SCHEMBL14219826 0.89 TDP1 (0.36) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14223203 0.89 KDM4E (0.36) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14219656 0.89 PTGS2 (0.41) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14219715 0.89 PTGS2 (0.41) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14223201 0.88 MEN1 (0.40) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14219832 0.85 MEN1 (0.45) TDP1MEN1KMT2ADHODHLCK
SCHEMBL14220114 0.83 PTGS2 (0.34) TDP1MEN1KMT2ADHODHPTGS2
SCHEMBL14219819 0.81 DHODH (0.46) MEN1KMT2ADHODHLCKLMNA

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
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed