SCHEMBL5835828

SCHEMBL5835828

COc1cc(Cl)c(S(=O)(=O)Cl)c(Cl)c1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.38
ACHE P22303 1/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36
TUBA1C Q9BQE3 1/20 0.36
TUBB6 Q9BUF5 1/20 0.36
TUBB2B Q9BVA1 1/20 0.36

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
SCHEMBL6288225 0.74 ACHE (0.46) ALDH1A1GAAHPGDACHETUBB4A
SCHEMBL4065639 0.74 TRPV4 (0.53) TRPV4ALDH1A1KDM4EGAAHPGD
SCHEMBL8764001 0.73 TRPV4 (0.43) TRPV4ALDH1A1KDM4EHPGDTUBB4A
SCHEMBL11655127 0.73 EPHX2 (0.43) TRPV4ALDH1A1ACHETUBB4ATUBB
SCHEMBL881433 0.73 ERN1 (0.40) ALDH1A1KDM4EHPGDACHETUBB4A
SCHEMBL12653142 0.71 ACHE (0.48) ALDH1A1KDM4EGAAHPGDACHE
SCHEMBL4469024 0.71 ALDH1A1 (0.42) TRPV4ALDH1A1KDM4EGAAMAPT
SCHEMBL2368094 0.71 CA9 (0.49) TRPV4ALDH1A1KDM4EGAAHPGD
SCHEMBL5835958 0.69 TRPV4 (0.56) TRPV4ALDH1A1KDM4EGAAHPGD
SCHEMBL2325686 0.69 CA1 (0.41) TRPV4ALDH1A1KDM4EGAAHPGD

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-7026349-B2 Sulfonamides SMITHKLINE BEECHAM CORPORATION (US) 2006-04-11 US disclosed