SCHEMBL19612413

SCHEMBL19612413

c1ccc(CCOc2ccc3c(OCCc4ccccc4)c(Oc4ccccc4)ccc3c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
MAOA P21397 7/20 0.43
MAOB P27338 6/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC16A3 O15427 1/20 0.41
ALOX5 P09917 2/20 0.41
PPARG P37231 2/20 0.41
FFAR1 O14842 1/20 0.41
PTGES O14684 1/20 0.41

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
SCHEMBL19612279 0.85 LTA4H (0.54) MEN1KMT2A
SCHEMBL19612315 0.84 ALOX5 (0.58) RAB9ANPC1MAOAMAOBMEN1
SCHEMBL19612543 0.82 LTA4H (0.55)
SCHEMBL19612219 0.81 RAB9A (0.53) ACHERAB9ANPC1MAOAMAOB
SCHEMBL19612414 0.81 MAOA (0.46) ACHERAB9ANPC1MAOAMAOB
SCHEMBL17912812 0.81 NPC1 (0.47) RAB9ANPC1MAOAMAOBSLC16A3
SCHEMBL17912818 0.81 NPC1 (0.47) RAB9ANPC1MAOAMAOBSLC16A3
SCHEMBL19612245 0.80 CNR1 (0.40) RAB9ANPC1MAOAMAOBKMT2A
SCHEMBL19612188 0.80 LTA4H (0.51) RAB9ANPC1MEN1KMT2A
SCHEMBL19612193 0.79 NPC1 (0.51) RAB9ANPC1MAOAMAOBALOX5

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-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed