SCHEMBL19970014

SCHEMBL19970014

CC(C)c1ccccc1-c1nc(NSc2cccc(N3CCC[C@@H](C(=O)O)C3)n2)ccc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 11/20 0.48
ICAM1 P05362 11/20 0.48
ITGAL P20701 11/20 0.48
DGAT2 Q96PD7 1/20 0.38
IDH2 P48735 1/20 0.38
MPL P40238 2/20 0.37
SYK P43405 1/20 0.35
NOTUM Q6P988 1/20 0.35
MAP3K5 Q99683 1/20 0.34
HSD11B1 P28845 1/20 0.34
ACACB O00763 1/20 0.34

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
SCHEMBL19970209 1.00 ITGB2 (0.48) ITGB2ICAM1ITGALDGAT2IDH2
SCHEMBL23770462 1.00 ITGB2 (0.48) ITGB2ICAM1ITGALDGAT2IDH2
SCHEMBL23770488 0.90 ITGB2 (0.40) ITGB2ICAM1ITGALIDH2MPL
SCHEMBL23770759 0.89 MPL (0.43) ITGB2ICAM1ITGALIDH2MPL
SCHEMBL19970130 0.89 ITGB2 (0.40) ITGB2ICAM1ITGALIDH2MPL
SCHEMBL19970013 0.89 ITGB2 (0.40) ITGB2ICAM1ITGALIDH2MPL
SCHEMBL23770689 0.89 ITGB2 (0.40) ITGB2ICAM1ITGALIDH2MPL
SCHEMBL23770635 0.89 IDH2 (0.39) ITGB2ICAM1ITGALDGAT2IDH2
SCHEMBL23770813 0.89 ITGB2 (0.40) ITGB2ICAM1ITGALDGAT2MPL
SCHEMBL23770456 0.88 IDH2 (0.39) ITGB2ICAM1ITGALDGAT2IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3504194-B1 N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-08-18 EP disclosed
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 ITGB2 2257/4885ICAM1 4057/4885ITGAL 2204/4885
US-20180072673-A1 N-(pyridin-2-yl)pyridine-sulfonamide Derivatives and their Use in the Treatment of Disease CFTR, P2RY1, P2RX5 ITGB2 2257/4885ICAM1 4057/4885ITGAL 2204/4885
US-10450273-B2 N-(pyridin-2-yl)pyridine-sulfonamide derivatives and their use in the treatment of disease CFTR, P2RY1, P2RX5 ITGB2 2257/4885ICAM1 4057/4885ITGAL 2204/4885

“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.