SCHEMBL8767453

SCHEMBL8767453

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
TSHR P16473 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.41
BLM P54132 2/20 0.39
CYP3A4 P08684 1/20 0.39
HTR1A P08908 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
NFKB1 P19838 1/20 0.39
CNR1 P21554 1/20 0.39
CYP2C19 P33261 1/20 0.39
ADRA1A P35348 1/20 0.39
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
THRB P10828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38

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
SCHEMBL8767110 0.91 LMNA (0.40) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8768360 0.91 L3MBTL1 (0.50) LMNATSHRSMN1; SMN2L3MBTL1HTT
SCHEMBL8103313 0.90 LMNA (0.45) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8768228 0.89 LMNA (0.45) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8917593 0.88 L3MBTL1 (0.43) LMNATSHRSMN1; SMN2L3MBTL1HTT
SCHEMBL8873584 0.84 LMNA (0.47) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8767144 0.83 LMNA (0.38) LMNASMN1; SMN2L3MBTL1HTTHPGD
SCHEMBL8768350 0.83 MAPT (0.44) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8874073 0.82 LMNA (0.47) LMNATSHRSMN1; SMN2HTTKMT2A
SCHEMBL8768279 0.81 LMNA (0.42) LMNATSHRSMN1; SMN2L3MBTL1HTT

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