SCHEMBL19612401

SCHEMBL19612401

CCCCCCCCOc1cc(OC)c(OCCCCCCCC)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.45
SRC P12931 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 1/20 0.43
SMPD1 P17405 3/20 0.43
TLR8 Q9NR97 1/20 0.43
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42

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
SCHEMBL19612633 0.94 SLC2A1 (0.50) SLC2A1SRCCNR1CNR2ALDH1A1
SCHEMBL29025217 0.85 CYP2C9 (0.49) SLC2A1MEN1KMT2ACNR1CNR2
SCHEMBL9627803 0.85 ALOX5 (0.52) SLC2A1MEN1KMT2ACNR1CNR2
SCHEMBL9629477 0.85 HTT (0.50) HTT
SCHEMBL19612375 0.84 LTA4H (0.53) MEN1KMT2ACNR1CNR2HTT
SCHEMBL17912845 0.84 SLC2A1 (0.47) SLC2A1MEN1KMT2ACNR1CNR2
SCHEMBL19612263 0.84 SMN1; SMN2 (0.53) MEN1KMT2ACNR1CNR2HTT
SCHEMBL23271817 0.83 S1PR5 (0.47) MEN1KMT2ACNR1CNR2HTT
SCHEMBL19612246 0.83 S1PR5 (0.47) MEN1KMT2ACNR1CNR2HTT
SCHEMBL23271786 0.83 S1PR5 (0.47) MEN1KMT2ACNR1CNR2HTT

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