SCHEMBL8517147

SCHEMBL8517147

[CH2]c1cccc(N(CC(C)C)S(=O)(=O)c2ccc3[nH]c(NC(=O)OC)nc3c2)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACR P10323 1/20 0.54
LMNA P02545 8/20 0.39
CYP1A2 P05177 5/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
HIF1A Q16665 4/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HTT P42858 3/20 0.39
HPGD P15428 3/20 0.39
TUBB4A P04350 4/20 0.39
TUBB P07437 4/20 0.39
TUBA3C P0DPH7 4/20 0.39
TUBA1B P68363 4/20 0.39
TUBA4A P68366 4/20 0.39
TUBB4B P68371 4/20 0.39
TUBB3 Q13509 4/20 0.39
TUBB2A Q13885 4/20 0.39
TUBB8 Q3ZCM7 4/20 0.39
TUBA3E Q6PEY2 4/20 0.39

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
SCHEMBL5031168 0.86 ACR (0.49) ACRLMNACYP1A2SMN1; SMN2HIF1A
SCHEMBL7609854 0.83 RORC (0.39) ACRKMT2ARORC
SCHEMBL6869361 0.82 ACR (0.44) ACRLMNACYP1A2SMN1; SMN2HIF1A
SCHEMBL5027206 0.81 ACR (0.44) ACRLMNACYP1A2SMN1; SMN2HIF1A
SCHEMBL5928370 0.78 ACR (0.42) ACRLMNACYP1A2SMN1; SMN2HIF1A
SCHEMBL8370885 0.76 ACR (0.43) ACRLMNACYP1A2SMN1; SMN2HIF1A
SCHEMBL7452491 0.73 KEAP1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7450471 0.73 RORC (0.39) LMNAALDH1A1KDM4EHPGDKMT2A
SCHEMBL7450627 0.72 RORC (0.46) RORC
SCHEMBL5172918 0.72 ACR (0.56) ACRLMNACYP1A2SMN1; SMN2HIF1A

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
WO-1999059989-A1 PROCESS FOR THE PREPARATION OF A BENZO FUSED HETEROCYCLO SULFONYL HALIDE INTERMEDIATE G.D. SEARLE & CO. (US) 1999-11-25 WO disclosed