SCHEMBL10592177

SCHEMBL10592177

CC(C)OC(C)C(CO)OC(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 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
SCHEMBL10591486 0.84 TSHR (0.32) TSHRTDP1
SCHEMBL13770693 0.78 TDP1 (0.40) TSHRTDP1
SCHEMBL14895464 0.78 TDP1 (0.40) TSHRTDP1
SCHEMBL19529291 0.77 — —
SCHEMBL20172545 0.76 TDP1 (0.38) TSHRTDP1
SCHEMBL10594570 0.74 TSHR (0.37) TSHRTDP1
SCHEMBL23220483 0.74 TDP1 (0.36) TSHRTDP1
SCHEMBL21782825 0.74 TDP1 (0.36) TSHRTDP1
SCHEMBL23220490 0.74 TDP1 (0.36) TSHRTDP1
SCHEMBL25670445 0.72 TDP1 (0.31) TDP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0341713-A2 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1989-11-15 — — EP disclosed
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