SCHEMBL30364650

SCHEMBL30364650

COc1nc(C2C[C@@H](C)C[C@@H](C)C2)ccc1C(=O)N[C@@H]1C=CS(=O)(=O)C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.36
JAK2 O60674 1/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 3/20 0.33
PABPC1 P11940 1/20 0.32
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL31547501 0.87 LMNA (0.42) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30364997 0.87 LMNA (0.44) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL25149343 0.83 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30365185 0.83 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30365013 0.82 LMNA (0.40) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30364621 0.81 LMNA (0.48) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30365111 0.81 LMNA (0.48) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30364760 0.80 LMNA (0.44) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30364609 0.80 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2JAK2
SCHEMBL30364744 0.78 LMNA (0.39) 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