SCHEMBL15411587

SCHEMBL15411587

CCCOc1[c]ccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
HTR1B P28222 9/20 0.40
HTR1D P28221 3/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TLR8 Q9NR97 1/20 0.36
PLA2G1B P04054 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
SLC6A4 P31645 1/20 0.35
HRH1 P35367 1/20 0.35
BTK Q06187 1/20 0.35

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
SCHEMBL2253959 0.92 GAA (0.47) CNR1CNR2HTR1BHTR1DGAA
SCHEMBL14658506 0.89 CNR1 (0.45) CNR1CNR2HTR1BHTR1DMEN1
SCHEMBL294076 0.89 CNR1 (0.45) CNR1CNR2HTR1BHTR1DMEN1
SCHEMBL1452144 0.86 ALOX5 (0.37) HTR1BMEN1KMT2ATSHRTDP1
SCHEMBL2496910 0.85 NCF1 (0.43) HTR1BHTR1DMEN1KMT2ATSHR
SCHEMBL2498963 0.85 KDM1A (0.39) HTR1BHTR1DTSHRSLC6A4HRH1
SCHEMBL891083 0.83 HTR1B (0.54) HTR1BHTR1DTSHRGAATDP1
SCHEMBL2502705 0.81 KMT2A (0.34) HTR1BHTR1DMEN1KMT2ATSHR
SCHEMBL2502508 0.79 MAPT (0.34) HTR1BHTR1DTSHRTDP1SLC6A4
SCHEMBL4630223 0.78 ELANE (0.39) HTR1BMEN1KMT2ATSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8834619-B2 Ink composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2014-09-16 US disclosed
EP-2687565-A1 INK COMPOSITION, INKJET PRINTING INK, AND INKJET PRINTING METHOD FUJIFILM Corporation (JP) 2014-01-22 EP disclosed
US-20140013997-A1 INK COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
CN-103429674-A Ink composition, ink for inkjet recording, and inkjet recording method FUJI PHOTO FILM CO LTD 2013-12-04 CN disclosed