SCHEMBL8970046

SCHEMBL8970046

CCCCOC1CCSC1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPP5C P53041 1/20 0.44
ALDH1A1 P00352 4/20 0.36
USP2 O75604 2/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GBA1 P04062 1/20 0.33
S1PR3 Q99500 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HCAR2 Q8TDS4 1/20 0.31
S1PR5 Q9H228 2/20 0.31
ATM Q13315 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
S1PR1 P21453 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
SCHEMBL8969295 0.95 PPP5C (0.40) PPP5CALDH1A1USP2GAAGBA1
SCHEMBL8970163 0.94 GBA1 (0.40) PPP5CALDH1A1GBA1S1PR3HCAR2
SCHEMBL8970296 0.94 GBA1 (0.40) PPP5CALDH1A1GBA1S1PR3HCAR2
SCHEMBL8970629 0.94 GBA1 (0.40) PPP5CALDH1A1GBA1S1PR3HCAR2
SCHEMBL8970303 0.94 GBA1 (0.40) PPP5CALDH1A1GBA1S1PR3HCAR2
SCHEMBL8970973 0.90 PPM1B (0.34) PPP5C
SCHEMBL8969256 0.83 ALDH1A1 (0.35) ALDH1A1USP2
SCHEMBL8969291 0.78 NAAA (0.43)
SCHEMBL8969146 0.76 NAAA (0.51)
SCHEMBL8969059 0.76 NAAA (0.51)

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