SCHEMBL25149262

SCHEMBL25149262

CC1(C)CCC(c2ccc(C(=O)N[C@@H]3C=CS(=O)(=O)C3)c(=O)[nH]2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.36
JAK2 O60674 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B2 P37059 6/20 0.33
HSD17B1 P14061 1/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
CRBN Q96SW2 1/20 0.31
POLB P06746 3/20 0.31
GFER P55789 1/20 0.31
PABPC1 P11940 1/20 0.30
CTDSP1 Q9GZU7 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
SCHEMBL25148746 0.90 LMNA (0.46) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25149229 0.90 LMNA (0.44) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25149422 0.87 LMNA (0.47) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25148721 0.87 LMNA (0.47) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25148716 0.87 LMNA (0.47) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL31547476 0.85 LMNA (0.45) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL31547477 0.80 LMNA (0.42) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25149390 0.79 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25148731 0.79 LMNA (0.45) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL31547579 0.77 MEN1 (0.46) LMNAMEN1KMT2ASMN1; 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