SCHEMBL1739101

SCHEMBL1739101

O=C1CCc2ccccc2C12CC1=CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BACE1 P56817 3/20 0.32
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM1A O60341 1/20 0.30
MAOB P27338 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
SCHEMBL1739240 0.85 GRM1 (0.31)
SCHEMBL9981681 0.84 TDP2 (0.37) BACE1KDM1A
SCHEMBL1737929 0.83 HPGD (0.36) BACE1
SCHEMBL9981639 0.82 KDM1A (0.35) HTR2AHTR2CBACE1KDM1A
SCHEMBL9981314 0.82 CA9 (0.36)
SCHEMBL9982791 0.82 ALDH1A1 (0.34)
SCHEMBL9982077 0.81 CA9 (0.35)
SCHEMBL9981506 0.81 SRD5A1 (0.35) BACE1KDM1A
SCHEMBL9981387 0.81 ALDH1A1 (0.41) ADRA2A
SCHEMBL9982570 0.81 KDM4E (0.31) BACE1

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-20120302713-A1 RETARDATION FILM, AND ORGANIC EL DISPLAY DEVICE AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME JX NIPPON OIL & ENERGY CORPORATION (JP) 2012-11-29 US disclosed
EP-2520956-A1 PHASE DIFFERENCE FILM, ORGANIC EL DISPLAY DEVICE AND LIQUID CRYSTAL DISPLAY USING THE SAME JX Nippon Oil & Energy Corporation (JP) 2012-11-07 EP disclosed
US-8211514-B2 Reverse dispersion retardation film and liquid crystal display device using the same JX NIPPON OIL & ENERGY CORPORATION (JP) 2012-07-03 US disclosed
EP-2390690-A1 INVERSELY DISPERSIVE RETARDATION FILM, AND LIQUID CRYSTAL DISPLAY DEVICE COMPRISING SAME JX Nippon Oil & Energy Corporation (JP) 2011-11-30 EP disclosed