SCHEMBL30908784

SCHEMBL30908784

CN(C)C1CCc2oc3ccc(NS(=O)(=O)c4cccc(Cl)c4)cc3c2C1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
TP53 P04637 7/20 0.55
SMN1; SMN2 Q16637 2/20 0.50
HTR6 P50406 5/20 0.49
HIF1A Q16665 1/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
LMNA P02545 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PKM P14618 1/20 0.47
THRB P10828 1/20 0.46
PGR P06401 3/20 0.46
PTPN2 P17706 2/20 0.46
PTPN1 P18031 2/20 0.46
PTPN5 P54829 1/20 0.46

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
SCHEMBL6957023 1.00 MAPT (0.55) MAPTTP53SMN1; SMN2HTR6HIF1A
SCHEMBL30908855 0.89 MAPT (0.57) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL6960878 0.89 MAPT (0.57) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL30908989 0.84 MAPT (0.57) MAPTTP53SMN1; SMN2HTR6HIF1A
SCHEMBL6958342 0.84 MAPT (0.57) MAPTTP53SMN1; SMN2HTR6HIF1A
SCHEMBL6953187 0.83 MAPT (0.58) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL30909109 0.82 MAPT (0.51) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL6949289 0.82 MAPT (0.51) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL6951459 0.81 TP53 (0.53) MAPTTP53SMN1; SMN2HTR6POLB
SCHEMBL6958103 0.81 MAPT (0.52) MAPTTP53SMN1; SMN2HTR6POLB

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
WO-2024073845-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ, LIMITED PARTNERSHIP (CA) 2024-04-11 WO disclosed