SCHEMBL5845748

SCHEMBL5845748

Fc1cc(-c2ccccn2)c(F)c(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 2/20 0.50
KDM4E B2RXH2 8/20 0.48
LMNA P02545 3/20 0.48
CCR1 P32246 3/20 0.48
CCR5 P51681 3/20 0.48
CCR8 P51685 3/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
METAP1 P53582 1/20 0.48
BLM P54132 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
TP53 P04637 3/20 0.42
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 2/20 0.42
HTT P42858 2/20 0.42

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
SCHEMBL13985935 0.90 KDM4E (0.54) CBFBKDM4ELMNACCR1CCR5
SCHEMBL5845637 0.83 KDM4E (0.46) CBFBKDM4ELMNACCR1CCR5
SCHEMBL18674805 0.83 CBFB (0.44) CBFBKDM4ELMNACCR1CCR5
SCHEMBL29901541 0.82 KDM4E (0.50) CBFBKDM4ELMNACCR1CCR5
SCHEMBL1356335 0.82 KDM4E (0.50) CBFBKDM4ELMNACCR1CCR5
SCHEMBL16903578 0.81 GRM5 (0.55) CBFBKDM4ELMNACCR1CCR5
SCHEMBL5844795 0.80 KDM4E (0.52) CBFBKDM4ELMNACCR1CCR5
SCHEMBL28128865 0.80 CBFB (0.41) CBFBKDM4ELMNACCR1CCR5
SCHEMBL31400260 0.78 KDM4E (0.54) CBFBKDM4ELMNACCR1CCR5
SCHEMBL12377643 0.78 KDM4E (0.54) CBFBKDM4ELMNACCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106749418-B Iridium complex and preparation method and application thereof 南京工业大学 2019-05-10 CN claimed
WO-2019215427-A1 PROCESS FOR FORMING A CARBON-CARBON BOND THE UNIVERSITY OF MANCHESTER (GB) 2019-11-14 WO disclosed
WO-2019215426-A1 PROCESS FOR FORMING A CARBON-CARBON BOND THE UNIVERSITY OF MANCHESTER (GB) 2019-11-14 WO disclosed
CN-106749418-B Iridium complex and preparation method and application thereof 南京工业大学 2019-05-10 CN disclosed
CN-106749418-B Iridium complex and preparation method and application thereof 南京工业大学 2019-05-10 CN disclosed
CN-103193568-B The selective hydrogenation reduction method of fluorine-containing arene derivatives 中国科学院上海有机化学研究所 2017-11-07 CN disclosed
CN-106749418-A Iridium complex and preparation method and application thereof 南京工业大学 2017-05-31 CN disclosed
CN-106749418-A Iridium complex and preparation method and application thereof 南京工业大学 2017-05-31 CN disclosed
CN-103193568-A Selective hydrogenation reduction method of fluorine-containing aromatic hydrocarbon derivative SHANGHAI INST ORGANIC CHEM 2013-07-10 CN disclosed
CN-1325503-C Luminous organic intermetallic compound and luminous element SANYO ELECTRIC CO (JP) 2007-07-11 CN disclosed
US-7067202-B2 Luminous efficiency and capable of emitting light of spectrum components of red or blue wavelength band; for use in organic electroluminescent device SANYO ELECTRIC CO., LTD. (JP) 2006-06-27 US disclosed
US-20050145830-A1 Phosphors and process for production thereof, luminescent compositions, and organic electroluminescent devices and processes for production thereof JSR CORPORATION (JP) 2005-07-07 US disclosed
EP-1516901-A1 PHOSPHORS AND PROCESS FOR PRODUCTION THEREOF, LUMINESCENT COMPOSITIONS, AND ORGANIC ELECTROLUMINESCENT DEVICES AND PROCESSES FOR PRODUCTION THEREOF JSR Corporation (JP) 2005-03-23 EP disclosed
EP-1484380-A1 POLYMERIC PHOSPHORS, PROCESS FOR PRODUCTION THEREOF, PHOSPHORESCENT COMPOSITIONS AND ARTICLES MADE BY USING THE SAME JSR Corporation (JP) 2004-12-08 EP disclosed
EP-1484381-A1 PHOSPHORS, PROCESS FOR PRODUCTION THEREOF, PHOSPHORESCENT COMPOSITIONS AND ARTICLES MADE BY USING THE SAME JSR Corporation (JP) 2004-12-08 EP disclosed
US-20040106006-A1 Phosphors, process for production thereof, phosphorescent compositions and articles made by using the same JSR CORPORATION (JP) 2004-06-03 US disclosed
US-20040091739-A1 Polymeric phosphorescent agent and production process thereof, and luminescent composition and applied products thereof JSR CORPORATION (JP) 2004-05-13 US disclosed
US-20030040627-A1 Luminescent organometallic compound and light emitting device SANYO ELECTRIC CO., LTD. (JP) 2003-02-27 US disclosed
CN-1397559-A Luminous organic intermetallic compound and luminous element SANYO ELECTRIC CO (JP) 2003-02-19 CN 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-20030040627-A1 Luminescent organometallic compound and light emitting device IK, CRY1, LBR CBFB 280/4885KDM4E 3641/4885LMNA 3413/4885

“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.