SCHEMBL21559953

SCHEMBL21559953

CCNC[C@](C)(O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
CFTR P13569 4/20 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
SCHEMBL6549124 0.76 TP53 (0.39) TP53
SCHEMBL28837325 0.74 CFTR (0.33) CFTR
SCHEMBL28811327 0.74 CFTR (0.33) CFTR
SCHEMBL28811326 0.74 CFTR (0.33) CFTR
SCHEMBL4410073 0.73
SCHEMBL27360028 0.73
SCHEMBL1133057 0.73
SCHEMBL3160885 0.73
SCHEMBL13771507 0.72 CFTR (0.31) CFTR
SCHEMBL7054792 0.72 TP53 (0.35) TP53

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-10633341-B2 Picolinic acid derivatives and their use as intermediates NOVARTIS AG (CH) 2020-04-28 US disclosed
US-20190345107-A1 NEW PICOLINIC ACID DERIVATIVES AND THEIR USE AS INTERMEDIATES NOVARTIS AG (CH) 2019-11-14 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-20190345107-A1 NEW PICOLINIC ACID DERIVATIVES AND THEIR USE AS INTERMEDIATES PYCR1, HADHA, HPD TP53 4385/4885CFTR 649/4885
US-10633341-B2 Picolinic acid derivatives and their use as intermediates HPD, PYCR1, PAH TP53 4437/4885CFTR 946/4885

“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.