SCHEMBL8970218

SCHEMBL8970218

CC(C)COC1CSCC1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35
GRM3 Q14832 1/20 0.35
RAB9A P51151 1/20 0.33
CPA1 P15085 1/20 0.33
CTSV O60911 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
CTSC P53634 1/20 0.31
CTSF Q9UBX1 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
SCHEMBL8970434 0.83 GPR88 (0.30)
SCHEMBL8970275 0.80 ALDH1A1 (0.36) GRM2GRM3
SCHEMBL8969140 0.77 GRM2 (0.35) GRM2GRM3
SCHEMBL8969365 0.77 MMP1 (0.35) GRM2GRM3CPA1
SCHEMBL8970016 0.77 ACE (0.32) GRM2GRM3
SCHEMBL8969248 0.76 GRM2 (0.31) GRM2GRM3
SCHEMBL8971023 0.76 RAB9A (0.39) GRM2GRM3RAB9ACPA1
SCHEMBL8970164 0.75 PPP5C (0.46) GRM2GRM3
SCHEMBL8970040 0.74 CTSV (0.31) CTSVCTSLCTSBCTSSCTSK
SCHEMBL8970403 0.74 RAB9A (0.40) GRM2GRM3RAB9ACTSVCTSL

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