SCHEMBL3286959

SCHEMBL3286959

CCCCCCCCPc1ccccc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.37
HSD11B1 P28845 3/20 0.36
TLR8 Q9NR97 1/20 0.36
HSD11B2 P80365 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
PLK1 P53350 1/20 0.33
PLK3 Q9H4B4 1/20 0.33
CDC25B P30305 1/20 0.33
KCNH2 Q12809 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL28050019 0.79 P2RX7 (0.37) EPHX2KCNH2ALDH1A1
SCHEMBL28049977 0.79 P2RX7 (0.37) EPHX2KCNH2ALDH1A1
SCHEMBL13387602 0.73 CYSLTR2 (0.35) ALDH1A1
SCHEMBL28863282 0.72 LIPG (0.47)
SCHEMBL27932102 0.72 LIPG (0.47)
SCHEMBL11119575 0.72 MEN1 (0.40) TLR8ALDH1A1
SCHEMBL5387664 0.71 KDM4E (0.40) KCNH2KDM4EALDH1A1HPGDTDP1
SCHEMBL5397688 0.71 KDM4E (0.40) KCNH2KDM4EALDH1A1HPGDTDP1
SCHEMBL5393198 0.71 KDM4E (0.40) KCNH2KDM4EALDH1A1HPGDTDP1
SCHEMBL5380785 0.71 KDM4E (0.40) KCNH2KDM4EALDH1A1HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7704468-B1 Method for forming an extraction agent for the separation of actinides from lanthanides BATTELLE ENERGY ALLIANCE, LLC (US) 2010-04-27 US claimed
US-20100094042-A1 METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES BATTELLE ENERGY ALLIANCE, LLC 2010-04-15 US claimed
US-7704468-B1 Method for forming an extraction agent for the separation of actinides from lanthanides BATTELLE ENERGY ALLIANCE, LLC (US) 2010-04-27 US disclosed
US-20100094042-A1 METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES BATTELLE ENERGY ALLIANCE, LLC 2010-04-15 US disclosed
US-20100094042-A1 METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES BATTELLE ENERGY ALLIANCE, LLC 2010-04-15 US disclosed
US-20100094042-A1 METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES BATTELLE ENERGY ALLIANCE, LLC 2010-04-15 US disclosed
WO-2007037995-A2 EXTRACTION AGENT AND METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES BATTELLE ENERGY ALLIANCE, LLC (US) 2007-04-05 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-20100094042-A1 METHOD FOR FORMING AN EXTRACTION AGENT FOR THE SEPARATION OF ACTINIDES FROM LANTHANIDES GLA, PPIP5K2, DDOST EPHX2 830/4885HSD11B1 2324/4885TLR8 4697/4885

“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.