SCHEMBL19970126

SCHEMBL19970126

O=C(O)[C@H]1CCCN(c2cccc(SNc3ccc(C(F)(F)F)c(-c4ccccc4C4CCC4)n3)n2)C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 1/20 0.39
ITGB2 P05107 4/20 0.39
ICAM1 P05362 4/20 0.39
ITGAL P20701 4/20 0.39
MPL P40238 2/20 0.37
NOTUM Q6P988 2/20 0.35
HSD11B1 P28845 1/20 0.35
SYK P43405 1/20 0.34
RBP4 P02753 2/20 0.34
TTR P02766 1/20 0.34
SERPINE1 P05121 1/20 0.34
DGAT2 Q96PD7 1/20 0.33
PROKR1 Q8TCW9 1/20 0.33
SCN9A Q15858 1/20 0.33
SLC6A1 P30531 1/20 0.33

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
SCHEMBL19970141 1.00 IDH2 (0.39) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770456 1.00 IDH2 (0.39) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770635 0.98 IDH2 (0.39) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770759 0.91 MPL (0.43) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770488 0.90 ITGB2 (0.40) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL19970130 0.89 ITGB2 (0.40) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL19970013 0.89 ITGB2 (0.40) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770689 0.89 ITGB2 (0.40) IDH2ITGB2ICAM1ITGALMPL
SCHEMBL23770485 0.88 P2RX7 (0.38) IDH2MPLNOTUMHSD11B1DGAT2
SCHEMBL23770462 0.88 ITGB2 (0.48) IDH2ITGB2ICAM1ITGALMPL

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-11066369-B2 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2021-07-20 US disclosed
US-10450273-B2 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2019-10-22 US disclosed
US-20180072673-A1 N-(pyridin-2-yl)pyridine-sulfonamide Derivatives and their Use in the Treatment of Disease NOVARTIS AG (CH) 2018-03-15 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 (3 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-11066369-B2 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease CFTR, P2RY1, P2RX5 IDH2 658/4885ITGB2 2257/4885ICAM1 4057/4885
US-20180072673-A1 N-(pyridin-2-yl)pyridine-sulfonamide Derivatives and their Use in the Treatment of Disease CFTR, P2RY1, P2RX5 IDH2 658/4885ITGB2 2257/4885ICAM1 4057/4885
US-10450273-B2 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease CFTR, P2RY1, P2RX5 IDH2 658/4885ITGB2 2257/4885ICAM1 4057/4885

“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.