SCHEMBL572976

SCHEMBL572976

CCCCCC(n1c2ccccc2c2ccccc21)n1c2ccccc2c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.44
CNR1 P21554 3/20 0.44
PGR P06401 1/20 0.44
RORA P35398 1/20 0.44
RORC P51449 1/20 0.44
RORB Q92753 1/20 0.44
UTS2R Q9UKP6 1/20 0.40
GPR3 P46089 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
HTR7 P34969 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC9A1 P19634 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CDC25A P30304 1/20 0.36

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
SCHEMBL573850 0.98 CNR1 (0.43) CNR2CNR1PGRRORARORC
SCHEMBL573291 0.94 PGR (0.45) CNR2CNR1PGRRORARORC
SCHEMBL574039 0.86 GPR3 (0.43) PGRRORARORCRORBUTS2R
SCHEMBL13772416 0.84 CNR2 (0.55) CNR2CNR1PGRRORARORC
SCHEMBL29354573 0.84 CNR1 (0.43) CNR2CNR1PGRRORARORC
SCHEMBL19388341 0.84 CNR1 (0.43) CNR2CNR1PGRRORARORC
SCHEMBL25721393 0.84 CNR1 (0.43) CNR2CNR1PGRRORARORC
SCHEMBL28267907 0.84 CNR1 (0.43) CNR2CNR1PGRRORARORC
SCHEMBL21894533 0.82 CNR1 (0.42) CNR2CNR1PGRRORARORC
SCHEMBL1001710 0.82 CNR2 (0.42) CNR2CNR1PGRRORARORC

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
EP-2601556-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM Nitto Denko Corporation (JP) 2013-06-12 EP disclosed
WO-2012018342-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2012-02-09 WO disclosed