SCHEMBL23634952

SCHEMBL23634952

O=S1(=O)CCN(CCCOI)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
HRH3 Q9Y5N1 3/20 0.36
SLC6A4 P31645 1/20 0.36
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPC1 O15118 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
DRD3 P35462 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
SCHEMBL23158358 0.88 HPGD (0.38) HPGDKMT2AMEN1ALDH1A1CYP1A2
SCHEMBL13202682 0.80 HPGD (0.41) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL1097457 0.79 KMT2A (0.37) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL22845716 0.77 HPGD (0.42) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL20807927 0.77 HPGD (0.39) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL14041545 0.77 HRH3 (0.45) HPGDHRH3KMT2AMEN1ALDH1A1
SCHEMBL8159902 0.76 HRH3 (0.52) HRH3ALDH1A1CYP2C19KDM4ESMN1; SMN2
SCHEMBL23871029 0.75 HRH3 (0.36) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL24400561 0.74 HRH3 (0.38) HPGDHRH3SLC6A4KMT2AMEN1
SCHEMBL23871026 0.74 HRH3 (0.36) HPGDHRH3SLC6A4KMT2AMEN1

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-3848363-B1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND MEDSHINE DISCOVERY INC (CN) 2023-07-19 EP disclosed
EP-3848363-A1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND Medshine Discovery Inc. (CN) 2021-07-14 EP disclosed