SCHEMBL9017754

SCHEMBL9017754

CCCCOc1cccc2cc3cccc(OCCCC)c3cc12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 8/20 0.54
MCHR1 Q99705 2/20 0.51
HTR1D P28221 2/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
TLR8 Q9NR97 1/20 0.47
SLC6A4 P31645 2/20 0.47
HRH1 P35367 1/20 0.47
GAA P10253 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KCNA3 P22001 1/20 0.46

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
SCHEMBL5579380 0.93 HTR1B (0.55) HTR1BMCHR1HTR1DCYP1A2CYP2C9
SCHEMBL9421991 0.88 KCNA3 (0.54) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL21633850 0.87 HTR1B (0.50) HTR1BMCHR1HTR1DCYP1A2CYP2C9
SCHEMBL12968143 0.86 HTR1B (0.49) HTR1BMCHR1HTR1DCYP1A2CYP2C9
SCHEMBL585194 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL20678360 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL17912877 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL17912804 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL17912798 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1
SCHEMBL17912869 0.86 KCNA3 (0.53) HTR1BMCHR1HTR1DCYP2C9CNR1

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-5501821-A OPTICAL ARTICLES FOR TRANSMISSION OF ELECTROMAGNETIC WAVES WITH DIPOLES EASTMAN KODAK COMPANY (US) 1996-03-26 US disclosed