SCHEMBL7939164

SCHEMBL7939164

CC(SNC(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1)c1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.59
RAB9A P51151 11/20 0.59
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 7/20 0.49
LMNA P02545 2/20 0.48
MAPT P10636 3/20 0.45
TP53 P04637 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
THRB P10828 1/20 0.45
PTPRC P08575 2/20 0.44
CTSL P07711 1/20 0.44
PTPN1 P18031 1/20 0.44
CTSS P25774 1/20 0.44
PTPN13 Q12923 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HTT P42858 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
SCHEMBL7938865 0.88 LMNA (0.64) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL7946533 0.86 TDP1 (0.58) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL7938891 0.85 RAB9A (0.60) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL7939069 0.78 LMNA (0.50) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL7947380 0.77 NPC1 (0.53) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6816024 0.77 NPC1 (0.60) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL18503022 0.77 MEN1 (0.75) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6815915 0.77 LMNA (0.46) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6812039 0.77 LMNA (0.46) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL6816035 0.73 NPC1 (0.55) NPC1RAB9AMEN1KMT2ATDP1

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-6262082-B1 Diaminopyridine-containing thiourea inhibitors of herpes viruses WYETH 2001-07-17 US disclosed