SCHEMBL25148693

SCHEMBL25148693

O=C(N[C@@H]1C=CS(=O)(=O)C1)c1cc(Cl)c(C2CCCCC2)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
JAK2 O60674 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
NPC1 O15118 3/20 0.34
RAB9A P51151 2/20 0.34
POLB P06746 2/20 0.32
CNR2 P34972 1/20 0.32
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31

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
SCHEMBL25148721 0.79 LMNA (0.47) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL25149422 0.79 LMNA (0.47) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL25148716 0.79 LMNA (0.47) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL31229541 0.78 LMNA (0.40) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL25149416 0.77 MEN1 (0.53) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL31422934 0.75 MEN1 (0.41) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL31273432 0.74 LMNA (0.42) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL31273506 0.74 LMNA (0.42) MEN1KMT2ALMNASMN1; SMN2JAK2
SCHEMBL30364979 0.74 KDM4E (0.43) POLBCA12CA1CA2CA3
SCHEMBL31423098 0.73 LMNA (0.39) MEN1KMT2ALMNASMN1; SMN2JAK2

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-2023062575-A1 CYCLIC VINYL SULFONE COMPOUNDS AS WRN INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2023-04-20 WO disclosed