SCHEMBL19972822

SCHEMBL19972822

CS(=O)(=O)c1cc(O)cc(S(C)(=O)=O)n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.41
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GLP1R P43220 2/20 0.34
BACE1 P56817 1/20 0.33
FYN P06241 1/20 0.33
MAP4K4 O95819 1/20 0.33
MINK1 Q8N4C8 1/20 0.33
TNIK Q9UKE5 1/20 0.33
SCD O00767 1/20 0.33
CA5A P35218 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
LOX P28300 1/20 0.31
LCK P06239 1/20 0.31
APLNR P35414 1/20 0.30

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
SCHEMBL24156661 0.87 ENPP2 (0.35) ENPP2LMNASMN1; SMN2GLP1RFYN
SCHEMBL6912864 0.75 LMNA (0.32) ENPP2LMNASMN1; SMN2GLP1R
SCHEMBL10949551 0.75 ALOX15 (0.46) LMNASMN1; SMN2FYNCA5AALDH1A1
SCHEMBL1162430 0.73 GLP1R (0.34) LMNASMN1; SMN2GLP1R
Hydrochloric Acid SCHEMBL10573659 0.73 ALOX15 (0.45) LMNASMN1; SMN2FYNCA5AALDH1A1
SCHEMBL9626200 0.72 LMNA (0.52) LMNASMN1; SMN2GLP1RALDH1A1MEN1
SCHEMBL10825036 0.71 LMNA (0.33) LMNASMN1; SMN2GLP1R
SCHEMBL10825037 0.71 LMNA (0.33) LMNASMN1; SMN2GLP1R
SCHEMBL11020040 0.70 LMNA (0.33) LMNASMN1; SMN2BACE1ALDH1A1MEN1
SCHEMBL24773615 0.70 HSP90AA1 (0.43) LMNASMN1; SMN2GLP1RALDH1A1

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
EP-3512846-A1 KETONE INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2019-07-24 EP disclosed
WO-2018053353-A1 KETONE INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2018-03-22 WO disclosed