SCHEMBL23770569

SCHEMBL23770569

Nc1cccc(SNc2ccc(C(F)(F)F)c(-c3ccccc3Cl)n2)n1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.34
HSD11B1 P28845 1/20 0.33
MPL P40238 1/20 0.32
BACE1 P56817 2/20 0.32
CTSA P10619 1/20 0.32
MYC P01106 1/20 0.31
WDR5 P61964 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TRPA1 O75762 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL23770610 0.90 BACE1 (0.38) MPLBACE1
SCHEMBL23770551 0.88 PTPN1 (0.36) MPLBACE1CTSATRPA1TRPM8
SCHEMBL23770756 0.87 BACE1 (0.36) HSD11B1MPLBACE1TRPA1TRPM8
SCHEMBL23770409 0.86 BACE1 (0.35) BACE1MYCWDR5KDM4E
SCHEMBL23770675 0.84 TRPA1 (0.35) BACE1TRPA1
SCHEMBL23770761 0.84 TRPA1 (0.34) BACE1TRPA1
SCHEMBL23770633 0.83 PLA2G7 (0.36) BACE1MYCWDR5KDM4E
SCHEMBL23770752 0.83 MPL (0.34) HSD11B1MPL
SCHEMBL23770549 0.82 ABL1 (0.32) MPL
SCHEMBL23770542 0.82 MPL (0.34) HSD11B1MPLBACE1

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