SCHEMBL9730351

SCHEMBL9730351

CC(C)COC(C)C(C)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 3/20 0.31
MAPK1 P28482 1/20 0.31
LMNA P02545 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
SCHEMBL737249 0.82 TDP1 (0.43) ALDH1A1TSHRMAPK1LMNA
SCHEMBL15119453 0.80 TDP1 (0.41) ALDH1A1TSHRMAPK1LMNA
SCHEMBL27957285 0.80
SCHEMBL27338396 0.79
SCHEMBL24311505 0.78 ALDH1A1 (0.32) ALDH1A1TSHRLMNA
SCHEMBL15119454 0.78 HSD17B10 (0.38)
SCHEMBL16093255 0.76 LMNA (0.38) ALDH1A1TSHRMAPK1LMNA
SCHEMBL9419450 0.76 LMNA (0.38) ALDH1A1TSHRMAPK1LMNA
Propylene Glycol SCHEMBL5833472 0.76 TDP1 (0.50) TSHRMAPK1LMNA
SCHEMBL3783651 0.76 RCE1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5167863-A Ferroelectricity; electrooptic switches HITACHI, LTD. (JP) 1992-12-01 US disclosed
EP-0322862-A2 Optically active compounds, their preparation and their use in liquid crystal compositions and liquid crystal optical modulators HITACHI, LTD. (JP) 1989-07-05 EP disclosed