SCHEMBL46496

SCHEMBL46496

CCCc1ccc(-n2c3ccc(CCn4c5ccccc5c5ccccc54)cc3c3cc(CCn4c5ccccc5c5ccccc54)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.47
RORA P35398 2/20 0.46
RORC P51449 2/20 0.46
RORB Q92753 2/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
PGR P06401 2/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
MAPK1 P28482 2/20 0.44
LMNA P02545 1/20 0.44
HDAC6 Q9UBN7 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
MAPT P10636 4/20 0.43
MCHR2 Q969V1 1/20 0.43
SMPD1 P17405 1/20 0.42
TP53 P04637 2/20 0.41
FDFT1 P37268 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL13776940 0.87 KDM4E (0.44) CNR2RORARORCRORBALDH1A1
SCHEMBL17758284 0.87 KDM4E (0.47) CNR2ALDH1A1HPGDPGRKDM4E
SCHEMBL25909682 0.87 KDM4E (0.56) CNR2RORARORCRORBALDH1A1
SCHEMBL39204 0.86 PGR (0.46) CNR2RORARORCRORBALDH1A1
SCHEMBL14849960 0.86 MAPT (0.54) CNR2RORARORCRORBALDH1A1
SCHEMBL46427 0.85 KDM4E (0.55) ALDH1A1HPGDPGRKDM4EATM
SCHEMBL46518 0.85 KDM4E (0.42) CNR2RORARORCRORBALDH1A1
SCHEMBL18648548 0.82 RORA (0.47) CNR2RORARORCRORBPGR
SCHEMBL46513 0.82 PTGER4 (0.53) CNR2RORARORCRORBALDH1A1
SCHEMBL2600216 0.81 KDM4E (0.62) ALDH1A1HPGDKDM4EPOLBMAPK1

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 5 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

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 CNR2 390/4885RORA 1035/4885RORC 1011/4885

“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.