SCHEMBL8868528

SCHEMBL8868528

COC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 3/20 0.50
POLB P06746 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 1/20 0.44
HTR1A P08908 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
CNR1 P21554 1/20 0.44
CYP2C19 P33261 1/20 0.44
ADRA1A P35348 1/20 0.44
BLM P54132 1/20 0.44
EGFR P00533 2/20 0.43
PPARA Q07869 1/20 0.41
EPHX2 P34913 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL8868346 0.91 P4HTM (0.45) P4HTMPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL8869360 0.90 P4HTM (0.50) P4HTMPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL8868336 0.90 P4HTM (0.44) P4HTMPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL8869066 0.90 PPARA (0.53) P4HTMKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL8869184 0.90 P4HTM (0.48) P4HTMKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL8868236 0.90 P4HTM (0.51) P4HTMPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL8869698 0.90 PPARA (0.53) P4HTMKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL8869375 0.89 P4HTM (0.51) P4HTMPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL8868460 0.89 MAPT (0.52) P4HTMKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL8868766 0.89 P4HTM (0.59) P4HTMPOLBKMT2AMEN1LMNA

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
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed