SCHEMBL1881174

SCHEMBL1881174

FC(F)(F)C(c1ccc(-c2cccc3ocnc23)cc1)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.37
▸ DHODH Q02127 1/20 0.37
▸ KLKB1 P03952 1/20 0.30
▸ ENPP1 P22413 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
SCHEMBL1881776 0.81 ENPP1 (0.43) NR4A2DHODHENPP1
SCHEMBL9467935 0.79 NR4A2 (0.44) NR4A2DHODHENPP1
SCHEMBL2169696 0.77 NR4A2 (0.38) NR4A2DHODHKLKB1ENPP1
SCHEMBL12637425 0.77 NR4A2 (0.42) NR4A2DHODHKLKB1ENPP1
SCHEMBL1884974 0.76 NR4A2 (0.43) NR4A2DHODHENPP1
SCHEMBL1881874 0.75 COMT (0.40) NR4A2DHODHKLKB1ENPP1
SCHEMBL12969981 0.75 NR4A2 (0.41) NR4A2DHODHKLKB1
SCHEMBL29349010 0.75 NR4A2 (0.41) NR4A2DHODHKLKB1
SCHEMBL1365239 0.74 NR4A2 (0.39) NR4A2DHODHKLKB1
SCHEMBL12637441 0.72 CMKLR1 (0.38) ENPP1

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-7939669-B2 Metallic compound and organic electroluminescence device comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-10 — — US disclosed
US-7939669-B2 Metallic compound and organic electroluminescence device comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-10 — — US disclosed
US-7939669-B2 Metallic compound and organic electroluminescence device comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-10 — — US disclosed
US-20090306395-A1 METALLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD., (KR) 2009-12-10 — — US disclosed
US-20090306395-A1 METALLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD., (KR) 2009-12-10 — — US disclosed
US-20090306395-A1 METALLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD., (KR) 2009-12-10 — — US 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-20090306395-A1 METALLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME SCO2, RPS4Y1, RER1 NR4A2 649/4885DHODH 4208/4885KLKB1 4730/4885

“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.

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