SCHEMBL23770409

SCHEMBL23770409

Nc1cccc(SNc2ccc(Cl)c(-c3ccccc3Cl)n2)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.35
MYC P01106 1/20 0.34
WDR5 P61964 1/20 0.34
EPHA4 P54764 1/20 0.32
HSP90AA1 P07900 2/20 0.32
DPP4 P27487 2/20 0.32
HSP90AB1 P08238 1/20 0.32
CNR1 P21554 2/20 0.32
DCUN1D1 Q96GG9 1/20 0.31
CNR2 P34972 1/20 0.31
SCN9A Q15858 2/20 0.31
APP P05067 3/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAOA P21397 1/20 0.31
MAPK1 P28482 1/20 0.31
ADRA1A P35348 1/20 0.31
SCN4A P35499 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
SCHEMBL23770590 0.90 ADORA2A (0.35) BACE1EPHA4HSP90AA1DPP4DCUN1D1
SCHEMBL23770633 0.89 PLA2G7 (0.36) BACE1MYCWDR5EPHA4HSP90AA1
SCHEMBL23770415 0.89 ADORA2A (0.34) BACE1DPP4GAATP53
SCHEMBL23770545 0.86 DHFR (0.30)
SCHEMBL23770605 0.86
SCHEMBL23770555 0.86 ADORA2A (0.32) MYCWDR5KDM4EALDH1A1KMT2A
SCHEMBL23770769 0.86 ALDH1A1 (0.38) HSP90AA1DPP4HSP90AB1DCUN1D1KDM4E
SCHEMBL23770569 0.86 EPAS1 (0.34) BACE1MYCWDR5KDM4E
SCHEMBL23770624 0.86
SCHEMBL23770756 0.86 BACE1 (0.36) BACE1DPP4SCN9AALDH1A1CYP2D6

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