SCHEMBL8970463

SCHEMBL8970463

CCCCCOC1CCCCCCC1O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 4/20 0.50
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
GSR P00390 2/20 0.38
NAAA Q02083 2/20 0.38
CYP1A2 P05177 1/20 0.36
TNF P01375 1/20 0.36
GBA2 Q9HCG7 1/20 0.35

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
SCHEMBL8969566 1.00 GBA1 (0.50) GBA1CA1CA2CA4GSR
SCHEMBL8969276 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8970039 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8970285 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8970213 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8970128 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8969568 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8971079 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8970188 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA
SCHEMBL8969233 0.98 GBA1 (0.53) GBA1CA1CA2CA4NAAA

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