SCHEMBL5591709

SCHEMBL5591709

FC(F)(F)c1ccccc1C1[C]c2ccccc2CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
HTR2C P28335 3/20 0.43
HTR2B P41595 1/20 0.37
RBP4 P02753 4/20 0.37
PNMT P11086 1/20 0.35
CYP2D6 P10635 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 1/20 0.33
CUL4A Q13619 1/20 0.33
IDO1 P14902 1/20 0.33
PDPK1 O15530 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32

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
SCHEMBL5591941 0.76 HTR2C (0.38) HTR2CHTR2B
SCHEMBL4931080 0.74 CYP1A2 (0.40) GAACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL10277092 0.73 ANPEP (0.40)
SCHEMBL3952833 0.73 BCL2L1 (0.39) IDO1PDPK1
SCHEMBL1634692 0.72 CYP11B2 (0.41) GAAMTNR1AMTNR1B
SCHEMBL4769652 0.70 PNMT (0.37) PNMTIDO1PDPK1MTNR1AMTNR1B
SCHEMBL3653495 0.68 PLAU (0.41) HTR2CHTR2BIDO1PDPK1
SCHEMBL5007618 0.67 HTR2C (0.75) GAATDP1HTR2CHTR2BRBP4
SCHEMBL5715615 0.67 POLB (0.38) GAATDP1
SCHEMBL26613553 0.67 HTR2C (0.46) GAATDP1HTR2CHTR2BRBP4

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
WO-2007076104-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2007-07-05 WO disclosed