SCHEMBL10608787

SCHEMBL10608787

CN1C(=O)CC(=O)N(c2ccccc2)S1(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 4/20 0.39
GAA P10253 3/20 0.39
MAPT P10636 2/20 0.39
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
CHRM1 P11229 1/20 0.39
TSHR P16473 1/20 0.39
PTGS1 P23219 1/20 0.39
DRD3 P35462 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
OPRK1 P41145 1/20 0.37
PDE4D Q08499 1/20 0.37
SLC6A2 P23975 2/20 0.37

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
SCHEMBL10611478 0.73 BRD4 (0.31) GAAKDM4EL3MBTL1
SCHEMBL17028772 0.68 MEN1 (0.38) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL12081988 0.65 MEN1 (0.64) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL22580612 0.65 MEN1 (0.64) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL181607 0.65 HPGD (0.47) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL5437358 0.63 OPRK1 (0.56) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL31006735 0.63 PTPN1 (0.44) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL14177454 0.62 TDP1 (0.48) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL5199351 0.62 GSK3B (0.71) KMT2AALDH1A1GAACYP1A2TSHR
SCHEMBL437784 0.62 HPGD (0.59) MEN1KMT2AALDH1A1GAAMAPT

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-4771048-A VETERINARY MEDICINE BAYER AKTIENGESELLSCHAFT (DE) 1988-09-13 US disclosed