SCHEMBL27303003

SCHEMBL27303003

CCOC(=O)CSC(C)(C)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
PRNP P04156 4/20 0.47
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PPID Q08752 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
TSHR P16473 2/20 0.43
RXFP1 Q9HBX9 2/20 0.43
ABCB1 P08183 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD11B1 P28845 1/20 0.43
ELANE P08246 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL1143585 0.85 SMN1; SMN2 (0.48) POLBPRNPALDH1A1SMN1; SMN2LMNA
SCHEMBL23956928 0.77 KIF11 (0.58) ALDH1A1MEN1KMT2A
SCHEMBL8079696 0.75 HSD11B1 (0.52) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL21447568 0.75 HSD11B1 (0.52) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5972547 0.75 CYP2C19 (0.61) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL313012 0.73 POLB (0.55) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8354123 0.73 GAA (0.48) POLBPRNPALDH1A1SMN1; SMN2LMNA
SCHEMBL2027600 0.73 LMNA (0.59) POLBPRNPALDH1A1SMN1; SMN2LMNA
SCHEMBL5972813 0.73 SMN1; SMN2 (0.51) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10334914 0.72 POLB (0.50) POLBALDH1A1SMN1; SMN2MEN1KMT2A

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
WO-2024049803-A1 BICYCLIC HETEROCYCLE COMPOUNDS FOR TREATMENT OF HERPES VIRUSES ASSEMBLY BIOSCIENCES, INC. (US) 2024-03-07 WO disclosed
WO-2024049803-A1 BICYCLIC HETEROCYCLE COMPOUNDS FOR TREATMENT OF HERPES VIRUSES ASSEMBLY BIOSCIENCES, INC. (US) 2024-03-07 WO disclosed