SCHEMBL1769746

SCHEMBL1769746

NC(=O)CCCCCCC(=O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.53
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.53
HTT P42858 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 4/20 0.42
MAPT P10636 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
LMNA P02545 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
ALOX5 P09917 2/20 0.41
KDM4A O75164 1/20 0.41
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
GAA P10253 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL10596450 1.00 NPSR1 (0.53) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL4138868 0.98 NPSR1 (0.55) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL629972 0.92 NPSR1 (0.61) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL17131834 0.92 NPSR1 (0.61) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL6673813 0.90 NPSR1 (0.63) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL3350100 0.89 ALDH1A1 (0.57) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL629973 0.87 NPSR1 (0.55) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL547693 0.87 NPSR1 (0.55) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL3242812 0.86 ALDH1A1 (0.40) NPSR1ALDH1A1NPC1POLBHTT
SCHEMBL16369620 0.86 ALDH1A1 (0.40) NPSR1ALDH1A1NPC1POLBHTT

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
WO-2011061545-A1 HPLC METHOD FOR ANALYZING VORINOSTAT GENERICS [UK] LIMITED (GB) 2011-05-26 WO claimed
EP-1260529-A1 Propylene polymers with improved properties Borealis Technology OY (FI) 2002-11-27 EP disclosed