SCHEMBL5884877

SCHEMBL5884877

CCCC=CC1CCc2c(ccc3c2CCC(c2ccc(OC(F)(F)F)cc2)C3)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
SGPL1 O95470 5/20 0.34
S1PR1 P21453 4/20 0.34
HTR2A P28223 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
KDM2B Q8NHM5 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
DRD2 P14416 1/20 0.30

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
SCHEMBL5884882 1.00 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684726 1.00 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684728 1.00 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684069 0.91 L3MBTL1 (0.37) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684060 0.91 L3MBTL1 (0.37) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684057 0.91 L3MBTL1 (0.37) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5684064 0.91 L3MBTL1 (0.37) L3MBTL1KDM1ARCOR1SGPL1S1PR1
SCHEMBL5686538 0.87 DRD2 (0.37) KDM1ARCOR1SGPL1S1PR1DRD2
SCHEMBL5686536 0.87 DRD2 (0.37) KDM1ARCOR1SGPL1S1PR1DRD2
SCHEMBL5686551 0.87 DRD2 (0.37) KDM1ARCOR1SGPL1S1PR1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067179-B1 Fused ring compound DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-06-27 US disclosed
EP-1201632-A1 FUSED RING COMPOUND DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-05-02 EP disclosed