SCHEMBL8970499

SCHEMBL8970499

CCCOC(=O)C1CSCC1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.45
PTPN1 P18031 1/20 0.45
PPP1CC P36873 1/20 0.45
HCAR2 Q8TDS4 1/20 0.35
LMNA P02545 1/20 0.33
ALDH1A1 P00352 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
PPARG P37231 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
SCHEMBL8969294 0.90 ALDH1A1 (0.41) PPM1BPTPN1PPP1CCHCAR2ALDH1A1
SCHEMBL8970154 0.88 PPARG (0.43) HCAR2ALDH1A1CHRM2CHRM4CHRM5
SCHEMBL8970105 0.87 PPARG (0.45) HCAR2NPSR1CHRM2CHRM4CHRM5
SCHEMBL8971150 0.87 PPARG (0.45) HCAR2NPSR1CHRM2CHRM4CHRM5
SCHEMBL8970238 0.87 PPARG (0.45) HCAR2NPSR1CHRM2CHRM4CHRM5
SCHEMBL8969975 0.87 PPARG (0.45) HCAR2NPSR1CHRM2CHRM4CHRM5
SCHEMBL8970447 0.87 PPARG (0.45) HCAR2NPSR1CHRM2CHRM4CHRM5
SCHEMBL8970200 0.85 PPM1B (0.42) PPM1BPTPN1PPP1CCALDH1A1
SCHEMBL8970081 0.82 PPM1B (0.38) PPM1BPTPN1PPP1CCHCAR2LMNA
SCHEMBL8970313 0.81 PPARG (0.33) PPM1BPTPN1PPP1CCPPARG

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