SCHEMBL23770692

SCHEMBL23770692

Cc1ccccc1-c1nc(NSc2cccc(N3CCN(C(=O)OC(C)(C)C)C(C(=O)O)C3)n2)ccc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 1/20 0.38
NR1H2 P55055 6/20 0.35
NR1H3 Q13133 5/20 0.35
TGM2 P21980 1/20 0.34
DPP4 P27487 1/20 0.33
WNT3 P56703 2/20 0.33
SFRP1 Q8N474 2/20 0.33
MAP4K4 O95819 1/20 0.33
MCL1 Q07820 1/20 0.33
HDAC1 Q13547 2/20 0.32
UCHL1 P09936 1/20 0.32
TTR P02766 1/20 0.32
CKS1B P61024 1/20 0.31
SKP1 P63208 1/20 0.31
SKP2 Q13309 1/20 0.31
MAPT P10636 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
SCHEMBL23770697 0.87 CKS1B (0.41) MAP4K4CKS1BSKP1SKP2MAPT
SCHEMBL23770700 0.87 HDAC6 (0.36) SFRP1MCL1CKS1BSKP1SKP2
SCHEMBL29464470 0.85 MCL1 (0.38) EIF2AK4NR1H2NR1H3TGM2DPP4
SCHEMBL19927718 0.85 MCL1 (0.38) EIF2AK4NR1H2NR1H3TGM2DPP4
SCHEMBL29464410 0.85 MCL1 (0.38) EIF2AK4NR1H2NR1H3TGM2DPP4
SCHEMBL19925691 0.85 MCL1 (0.38) EIF2AK4NR1H2NR1H3TGM2DPP4
SCHEMBL23770806 0.84 RBP4 (0.36) TTR
SCHEMBL23770608 0.83 NOTUM (0.41) TTR
SCHEMBL23770488 0.82 ITGB2 (0.40) TTRMAPT
SCHEMBL23770674 0.81 MPL (0.38) EIF2AK4TTR

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 1 patent. 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