SCHEMBL20887231

SCHEMBL20887231

CN(C)S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
SMN1; SMN2 Q16637 3/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
ALDH1A1 P00352 3/20 0.63
MCOLN3 Q8TDD5 1/20 0.63
KDM4E B2RXH2 1/20 0.57
MAPT P10636 4/20 0.54
HTR1A P08908 1/20 0.54
HTR2A P28223 1/20 0.54
HTR7 P34969 1/20 0.54
HTR6 P50406 1/20 0.54
LMNA P02545 2/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53
ALOX12 P18054 1/20 0.53
POLB P06746 1/20 0.52

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
SCHEMBL2156435 0.83 ALDH1A1 (0.67) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL18164586 0.82 MEN1 (0.71) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL20886901 0.81 MEN1 (0.58) MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL6714846 0.80 ALDH1A1 (0.75) SMN1; SMN2ALDH1A1MAPTHTR1AHTR2A
SCHEMBL11100857 0.80 ALDH1A1 (0.75) SMN1; SMN2ALDH1A1MAPTHTR1AHTR2A
SCHEMBL20887239 0.79 MEN1 (0.56) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL20887233 0.77 MEN1 (0.65) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL20887227 0.77 LMNA (0.57) MEN1KMT2ASMN1; SMN2KDM4ELMNA
SCHEMBL20887055 0.76 ALDH1A1 (0.64) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5249712 0.76 LMNA (0.68) MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1

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-2019071104-A1 COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF HYPERAMMONEMIA CHILDREN'S NATIONAL MEDICAL CENTER (US) 2019-04-11 WO disclosed