SCHEMBL12757166

SCHEMBL12757166

COc1ccc(N(C)c2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.61
HPGD P15428 4/20 0.61
RAB9A P51151 2/20 0.61
NPC1 O15118 1/20 0.61
CES2 O00748 1/20 0.61
CES1 P23141 1/20 0.61
KDM4E B2RXH2 2/20 0.55
KMT2A Q03164 3/20 0.54
LMNA P02545 3/20 0.54
ELANE P08246 2/20 0.54
MAPT P10636 2/20 0.54
MAPK1 P28482 2/20 0.54
MEN1 O00255 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
ALDH1A1 P00352 3/20 0.50
GAA P10253 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL9806081 0.97 ACHE (0.61) ACHEHPGDRAB9ANPC1CES2
Benzophenone SCHEMBL27935236 0.88 CES2 (0.77) ACHEHPGDRAB9ANPC1CES2
SCHEMBL50261 0.88 CES2 (0.77) ACHEHPGDRAB9ANPC1CES2
SCHEMBL6618691 0.88 CES2 (0.77) ACHEHPGDRAB9ANPC1CES2
SCHEMBL12757181 0.87 LMNA (0.54) ACHEHPGDRAB9ANPC1CES2
Anisole SCHEMBL27591330 0.87 RAB9A (0.77) ACHEHPGDRAB9ANPC1CES2
SCHEMBL28888786 0.86 CES2 (0.74) ACHEHPGDRAB9ANPC1CES2
Hydrochloric Acid SCHEMBL4595093 0.86 CES2 (0.74) ACHEHPGDRAB9ANPC1CES2
SCHEMBL28393149 0.86 CES2 (0.74) ACHEHPGDRAB9ANPC1CES2
SCHEMBL9500449 0.86 HPGD (0.74) HPGDRAB9ANPC1KMT2ALMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2302007-B1 Ink composition and inkjet recording method FUJIFILM CORP (JP) 2014-01-29 EP disclosed
US-8342674-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-01-01 US disclosed
US-8342674-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-01-01 US disclosed
US-20110074897-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
US-20110074897-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
EP-2302007-A1 Ink composition and inkjet recording method FUJIFILM Corporation (JP) 2011-03-30 EP disclosed