SCHEMBL8768360

SCHEMBL8768360

COc1cc(C(=O)NS(=O)(=O)c2ccc(C(=O)NC3CCCCC3)cc2)cnc1OC(=O)NCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 5/20 0.44
TSHR P16473 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
BLM P54132 3/20 0.43
KMT2A Q03164 2/20 0.43
PPARG P37231 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
ABCC8 Q09428 2/20 0.43
MEN1 O00255 1/20 0.43
ABCC3 O15438 1/20 0.43
ABCC4 O15439 1/20 0.43
ABCC9 O60706 1/20 0.43
ABCB11 O95342 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL8767453 0.91 LMNA (0.42) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8768279 0.91 LMNA (0.42) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8097853 0.89 LMNA (0.49) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8103050 0.89 LMNA (0.44) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8916898 0.87 L3MBTL1 (0.52) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8104049 0.87 LMNA (0.39) L3MBTL1LMNATSHRSMN1; SMN2HTT
SCHEMBL8766943 0.85 PTGS2 (0.48) TSHRCYSLTR1TDP1
SCHEMBL8767162 0.82 LMNA (0.40) L3MBTL1LMNASMN1; SMN2HTTBLM
SCHEMBL8767110 0.82 LMNA (0.40) LMNATSHRSMN1; SMN2HTTALDH1A1
SCHEMBL8097851 0.82 LMNA (0.51) L3MBTL1LMNATSHRSMN1; SMN2HTT

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-0673931-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 1997-08-13 EP disclosed