SCHEMBL4781263

SCHEMBL4781263

CC(C)C(=O)c1ccn(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.70
TUBB4A P04350 2/20 0.54
TUBB P07437 2/20 0.54
TUBA3C P0DPH7 2/20 0.54
TUBA1B P68363 2/20 0.54
TUBA4A P68366 2/20 0.54
TUBB4B P68371 2/20 0.54
TUBB3 Q13509 2/20 0.54
TUBB2A Q13885 2/20 0.54
TUBB8 Q3ZCM7 2/20 0.54
TUBA3E Q6PEY2 2/20 0.54
TUBA1A Q71U36 2/20 0.54
TUBA1C Q9BQE3 2/20 0.54
TUBB6 Q9BUF5 2/20 0.54
TUBB2B Q9BVA1 2/20 0.54
TUBB1 Q9H4B7 2/20 0.54
HDAC6 Q9UBN7 1/20 0.52
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL9590857 0.86 PKM (0.68) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27674625 0.86 PKM (0.63) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1366438 0.83 PKM (1.00) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4780674 0.79 PKM (0.70) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2717445 0.77 PKM (0.67) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27648529 0.76 PKM (0.57) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL14278743 0.75 PKM (0.68) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1516211 0.75 PKM (0.64) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27744199 0.74 PKM (0.63) PKMTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5899359 0.74 PKM (0.62) PKMTUBB4ATUBBTUBA3CTUBA1B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed