SCHEMBL20995362

SCHEMBL20995362

FC(F)(F)c1ccc(-c2cn(C(F)(F)F)nn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 2/20 0.49
▸ EPHB4 P54760 2/20 0.46
▸ SCN5A Q14524 1/20 0.45
▸ P2RY14 Q15391 6/20 0.45
▸ TEK Q02763 2/20 0.45
▸ KIF11 P52732 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ HSP90AB1 P08238 1/20 0.42
▸ OPRD1 P41143 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ F2RL3 Q96RI0 1/20 0.40
▸ S1PR1 P21453 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
SCHEMBL20995385 0.86 PTGS2 (0.47) PTGS2EPHB4SCN5AP2RY14TEK
SCHEMBL20995366 0.84 PTGS2 (0.43) PTGS2SCN5ACA12CA9
SCHEMBL20995349 0.82 P2RY14 (0.41) PTGS2P2RY14KIF11HSP90AA1HSP90AB1
SCHEMBL20995390 0.82 FLT3 (0.45) PTGS2EPHB4TEKCA12CA9
SCHEMBL20995389 0.81 CYP19A1 (0.47) PTGS2EPHB4TEKCA12CA9
SCHEMBL12413911 0.79 EPHB4 (0.54) PTGS2EPHB4SCN5AP2RY14TEK
SCHEMBL20995348 0.78 HSP90AA1 (0.54) PTGS2SCN5AHSP90AA1HSP90AB1
SCHEMBL20995365 0.76 KMT2A (0.46) F2RL3
SCHEMBL12377265 0.75 PTGS2 (0.49) PTGS2EPHB4SCN5AP2RY14TEK
SCHEMBL12420376 0.73 PTGS2 (0.65) PTGS2P2RY14CA12CA9KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190161452-A1 Process for the preparation of azidoperfluoroalkanes and N-polyfluoroalkyl azides USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V.V.I. (CZ) 2019-05-30 — — US claimed
US-10590091-B2 Process for the preparation of azidoperfluoroalkanes and N-polyfluoroalkyl azides Ustav Organicke Chemie A Biochemie AV CR , v.v.i. (CZ) 2020-03-17 — — US disclosed
US-20190161452-A1 Process for the preparation of azidoperfluoroalkanes and N-polyfluoroalkyl azides USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V.V.I. (CZ) 2019-05-30 — — 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 (2 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-10590091-B2 Process for the preparation of azidoperfluoroalkanes and N-polyfluoroalkyl azides CYP2F1, PRXL2A, CRBN PTGS2 3378/4885EPHB4 2987/4885SCN5A 2394/4885
US-20190161452-A1 Process for the preparation of azidoperfluoroalkanes and N-polyfluoroalkyl azides CYP2F1, PRXL2A, CRBN PTGS2 3378/4885EPHB4 2987/4885SCN5A 2394/4885

“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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