SCHEMBL4577336

SCHEMBL4577336

CC(N)(O)NC(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.42
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX1 P07099 1/20 0.33
PDK1 Q15118 4/20 0.32
PDK2 Q15119 4/20 0.32
PDK3 Q15120 4/20 0.32
PDK4 Q16654 4/20 0.32
CA3 P07451 2/20 0.31
CA5A P35218 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
CA12 O43570 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL2757992 0.76 CA2 (0.48) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL22971344 0.72 CA2 (0.43) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL7478228 0.72 CA2 (0.43) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL27524175 0.71 CA2 (0.39) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL2597673 0.70
SCHEMBL4463196 0.70 KDM4C (0.42) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL1618588 0.69 CA2 (0.53) CA2ALDH1A1POLBSMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL4469009 0.68 KDM4C (0.41) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL28995827 0.68 CA2 (0.40) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL4469005 0.68 CA2 (0.40) CA2ALDH1A1POLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7462451-B2 Compositions for modifying nucleic acids THIRD WAVE TECHNOLOGIES, INC. (US) 2008-12-09 US disclosed
US-20050277138-A1 Reactive functional groups THIRD WAVE TECHNOLOGIES, INC. (US) 2005-12-15 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-20050277138-A1 Reactive functional groups RNGTT, POLRMT, NSUN2 CA2 1611/4885ALDH1A1 2481/4885POLB 82/4885

“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.