SCHEMBL8970385

SCHEMBL8970385

CCCOC1CCCCC1O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
GBA1 P04062 1/20 0.36
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
NPY4R P50391 1/20 0.36
NPY5R Q15761 1/20 0.36
LIPE Q05469 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL8970087 0.98 GSR (0.46) GSRCA1CA2CA4GBA1
SCHEMBL5831500 0.98 GSR (0.46) GSRCA1CA2CA4GBA1
SCHEMBL8969837 0.96 GSR (0.39) GSRCA1CA2CA4GBA1
SCHEMBL13326285 0.88 GBA1 (0.45) GSRCA1CA2CA4GBA1
SCHEMBL7195617 0.88 GBA1 (0.45) GSRCA1CA2CA4GBA1
SCHEMBL18928412 0.86 GSR (0.45) GSRCA1CA2CA4NPY1R
SCHEMBL8969080 0.86 GBA1 (0.44) GSRCA1CA2CA4GBA1
SCHEMBL8969511 0.86 GBA1 (0.51) GSRCA1CA2CA4GBA1
SCHEMBL19526296 0.86 GBA1 (0.44) GSRCA1CA2CA4GBA1
SCHEMBL5831411 0.86 GBA1 (0.44) GSRCA1CA2CA4GBA1

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