SCHEMBL8926068

SCHEMBL8926068

CC1(C)OC(=S)N[C@H]1Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.37
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
ABCB1 P08183 1/20 0.33

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
SCHEMBL531694 0.80 LMNA (0.42) CA2LMNATSHRNPSR1SMN1; SMN2
SCHEMBL531693 0.80 LMNA (0.42) CA2LMNATSHRNPSR1SMN1; SMN2
SCHEMBL2369273 0.80 LMNA (0.42) CA2LMNATSHRNPSR1SMN1; SMN2
SCHEMBL9852828 0.70 CA2 (0.42) CA2ALDH1A1HSD17B10TP53
SCHEMBL6982093 0.63 HDAC8 (0.44) CA2LMNAALDH1A1GAAPOLB
SCHEMBL6977385 0.63 MAOB (0.37) DDB1CRBN
SCHEMBL7417047 0.63 GLA (0.66) TSHRNPSR1HTT
SCHEMBL13949518 0.63 LMNA (0.38) CA2LMNAALDH1A1HSD17B10NPSR1
SCHEMBL5872462 0.62 HDAC8 (0.36) CA2TSHRGAAPOLBCYP1A2
SCHEMBL31403360 0.62 HDAC8 (0.36) CA2TSHRGAAPOLBCYP1A2

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
JP-9124621-A None JP disclosed
JP-H09124621-A OPTICALLY ACTIVE 1,3-OXAZOLIDINE-2-THIONE DERIVATIVE SHIRATORI SEIYAKU KK 1997-05-13 JP disclosed