SCHEMBL11048003

SCHEMBL11048003

O=S(=O)(c1[c]cccc1)c1ccccc1Oc1ccccc1S(=O)(=O)c1[c]cccc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.40
ELANE P08246 1/20 0.34
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.31
CASP1 P29466 2/20 0.31

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
SCHEMBL150811 0.78 HTR6 (0.38) HTR6ELANEKMT2AMEN1GAA
SCHEMBL6295690 0.78 KMT2A (0.33) KMT2AMEN1GAA
SCHEMBL11692931 0.76 MYC (0.36) KMT2AMEN1GAA
SCHEMBL9495334 0.76 AKR1B1 (0.41) KMT2AMEN1
SCHEMBL5146128 0.76 HSD11B1 (0.45) GAA
SCHEMBL5144369 0.76 KDM4E (0.41) LMNAMAPTGAA
SCHEMBL11143075 0.71 SMN1; SMN2 (0.48) HTR6LMNA
SCHEMBL315684 0.71 HTR6 (0.54) HTR6KMT2AGAA
SCHEMBL8941544 0.70 ALDH1A1 (0.50) ELANELMNAMAPTKMT2AMEN1
SCHEMBL10438578 0.69 PTGS2 (0.40) HTR6LMNAMAPTKMT2AMEN1

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-4481350-A TRANSESTERIFICATION CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1984-11-06 US claimed