SCHEMBL8969507

SCHEMBL8969507

CC(=O)OC1CCSC1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.38
CHRM1 P11229 3/20 0.38
KMT2A Q03164 2/20 0.38
CYP2D6 P10635 2/20 0.38
MEN1 O00255 1/20 0.38
CHRM4 P08173 2/20 0.38
CHRM3 P20309 2/20 0.38
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.32
SLC18A3 Q16572 2/20 0.31
CYP2C19 P33261 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
SCHEMBL8970898 0.80 CHRM2 (0.42) CHRM2CHRM1CHRM4CHRM3
SCHEMBL8970077 0.80
SCHEMBL8969548 0.80
SCHEMBL8969088 0.78 SLC18A3 (0.38) CHRM2CHRM1CHRM4CHRM3SLC18A3
SCHEMBL8969471 0.76 MMP1 (0.34) CHRM2CHRM1KMT2AMEN1CHRM4
SCHEMBL19261955 0.76 CHRM2 (0.43) CHRM2CHRM1KMT2ACYP2D6MEN1
SCHEMBL19261971 0.76 CHRM2 (0.43) CHRM2CHRM1KMT2ACYP2D6MEN1
SCHEMBL8969089 0.76
SCHEMBL8970071 0.73 CHRM2 (0.34) CHRM2CHRM1CHRM4CHRM3
SCHEMBL8970973 0.73 PPM1B (0.34)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed