SCHEMBL39204

SCHEMBL39204

OCc1ccc(-n2c3ccc(CCn4c5ccccc5c5ccccc54)cc3c3cc(CCn4c5ccccc5c5ccccc54)ccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
POLB P06746 3/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 3/20 0.43
ATM Q13315 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
CNR2 P34972 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RORA P35398 1/20 0.40
RORC P51449 1/20 0.40
RORB Q92753 1/20 0.40
FABP4 P15090 2/20 0.40
FABP5 Q01469 2/20 0.40
FABP3 P05413 1/20 0.40

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
SCHEMBL46518 0.87 KDM4E (0.42) PGRHDAC6POLBMAPTKDM4E
SCHEMBL46496 0.86 CNR2 (0.47) PGRHDAC6POLBMAPTKDM4E
SCHEMBL46513 0.84 PTGER4 (0.53) PGRHDAC6POLBMAPTKDM4E
SCHEMBL14839698 0.83 HDAC6 (0.50) PGRHDAC6POLBMAPTKDM4E
SCHEMBL14849960 0.83 MAPT (0.54) PGRHDAC6POLBMAPTKDM4E
SCHEMBL46502 0.83 KDM4E (0.61) POLBKDM4EATML3MBTL1ALDH1A1
SCHEMBL18648450 0.82 PGR (0.36) PGRHDAC6POLBMAPTKDM4E
SCHEMBL1201083 0.82 KDM4E (0.48) PGRPOLBMAPTKDM4EATM
SCHEMBL3787566 0.82 KDM4E (0.48) PGRPOLBMAPTKDM4EATM
SCHEMBL5322058 0.80 HDAC6 (0.51) PGRHDAC6POLBMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598450-B2 Emissive compounds for organic light-emitting diodes NITTO DENKO CORPORATION (JP) 2017-03-21 US disclosed
US-9598450-B2 Emissive compounds for organic light-emitting diodes NITTO DENKO CORPORATION (JP) 2017-03-21 US disclosed
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2013-04-11 US disclosed
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2013-04-11 US disclosed
WO-2011149500-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2011-12-01 WO disclosed
WO-2011149500-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2011-12-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES CRY2, PPOX, CRY1 PGR 61/4885HDAC6 3609/4885POLB 2569/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.