SCHEMBL14537

SCHEMBL14537

CC(C)c1ccc(S(=O)(=O)NC2CCOCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.55
USP30 Q70CQ3 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
RECQL P46063 1/20 0.53
ALDH1A1 P00352 6/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 1/20 0.49
KCNH2 Q12809 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
HTT P42858 2/20 0.47
LMNA P02545 2/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL12352556 0.89 UCHL1 (0.62) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL10282902 0.86 SMN1; SMN2 (0.68) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL14132463 0.86 SMN1; SMN2 (0.73) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL14132621 0.84 SMN1; SMN2 (0.71) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL23806536 0.84 SMN1; SMN2 (0.71) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL14842518 0.83 KDM4E (0.58) SMN1; SMN2KDM4ERECQLALDH1A1CYP3A4
SCHEMBL24477877 0.83 SMN1; SMN2 (0.58) SMN1; SMN2KDM4ERECQLALDH1A1CYP3A4
SCHEMBL10124067 0.83 ALDH1A1 (0.71) SMN1; SMN2KDM4ERECQLALDH1A1CYP3A4
SCHEMBL20082404 0.82 UCHL1 (0.55) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL14923992 0.81 USP30 (0.64) UCHL1USP30SMN1; SMN2KDM4ERECQL

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-2011047319-A2 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME RIB-X PHARMACEUTICALS, INC. (US) 2011-04-21 WO disclosed