SCHEMBL19977035

SCHEMBL19977035

CC(NC(=O)c1ccccc1F)C(=O)Nc1ccccc1OC(F)F

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.53
HTT P42858 2/20 0.53
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 2/20 0.48
RAB9A P51151 1/20 0.46
ALOX12 P18054 1/20 0.46
KDM4E B2RXH2 1/20 0.44
PYGL P06737 2/20 0.44
TSHR P16473 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
CASP1 P29466 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL19976916 0.88 KMT2A (0.51) KMT2AMEN1SMN1; SMN2HTTRAB9A
SCHEMBL19976990 0.88 KMT2A (0.60) KMT2AMEN1SMN1; SMN2HTTTDP1
SCHEMBL19977046 0.87 KMT2A (0.50) KMT2AMEN1SMN1; SMN2HTTL3MBTL1
SCHEMBL19976893 0.84 SMN1; SMN2 (0.60) KMT2AMEN1SMN1; SMN2HTTPOLB
SCHEMBL19976954 0.81 KMT2A (0.53) KMT2AMEN1SMN1; SMN2TDP1L3MBTL1
SCHEMBL19976906 0.81 PGR (0.52) KMT2AMEN1SMN1; SMN2HTTTDP1
SCHEMBL16993984 0.81 KMT2A (0.55) KMT2AMEN1SMN1; SMN2HTTTDP1
SCHEMBL19977009 0.79 KMT2A (0.53) KMT2AMEN1SMN1; SMN2HTTTDP1
SCHEMBL19977006 0.79 APLNR (0.54) KMT2AMEN1SMN1; SMN2HTTRAB9A
SCHEMBL12780373 0.78 KMT2A (0.66) KMT2AMEN1SMN1; SMN2HTTL3MBTL1

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
US-9919998-B2 Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-03-20 US disclosed