SCHEMBL8483651

SCHEMBL8483651

C#CC(C)(C)Oc1ccc(S(=O)(=O)Nc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ PKM P14618 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ CA12 O43570 3/20 0.54
▸ CA9 Q16790 3/20 0.54
▸ CA1 P00915 1/20 0.54
▸ CA2 P00918 1/20 0.54
▸ IL1RN P18510 1/20 0.53
▸ KEAP1 Q14145 1/20 0.53
▸ ERAP1 Q9NZ08 1/20 0.53
▸ PGR P06401 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ FFAR1 O14842 2/20 0.52
▸ RECQL P46063 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ FFAR4 Q5NUL3 1/20 0.49
▸ GAA P10253 1/20 0.49

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
SCHEMBL9294669 0.82 SMN1; SMN2 (0.46) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL13945780 0.79 PGR (0.66) KMT2AMEN1PKMALDH1A1CA12
SCHEMBL7572608 0.79 KMT2A (0.61) KMT2AMEN1PKMALDH1A1CA12
SCHEMBL9195881 0.77 PTGS2 (0.41) ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL812663 0.77 PGR (0.82) KMT2AMEN1PKMALDH1A1CA12
SCHEMBL9231028 0.76 PGR (0.83) KMT2AMEN1PKMALDH1A1CA12
SCHEMBL18405594 0.76 CA4 (0.39) KMT2AMEN1ALDH1A1MAPTMAPK1
SCHEMBL7826045 0.75 CA2 (0.51) ALDH1A1CA12CA9CA1CA2
SCHEMBL9232766 0.73 KMT2A (0.67) KMT2AMEN1PKMALDH1A1CA12
SCHEMBL12042475 0.73 ALDH1A1 (0.71) KMT2AMEN1PKMALDH1A1CA12

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-5905156-A POTASSIUM CHANNEL ACTIVATORS AND BRONCHODILATORS NOVARTIS AG (CH) 1999-05-18 — — US disclosed
Send feedback