SCHEMBL8769501

SCHEMBL8769501

CC[CH]OC(CC)OC(CC)OC(C)=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL8769035 0.90 TSHR (0.36) TSHR
SCHEMBL839373 0.79 TSHR (0.33) TSHR
SCHEMBL315270 0.75 TSHR (0.48) TSHR
SCHEMBL8529924 0.74
SCHEMBL2252803 0.74 TSHR (0.50) TSHR
SCHEMBL9481672 0.72 TSHR (0.37) TSHR
SCHEMBL8775768 0.72 TSHR (0.42) TSHR
SCHEMBL8769650 0.72 TSHR (0.50) TSHR
SCHEMBL16024 0.69
SCHEMBL23529412 0.68 TSHR (0.38) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548715-B1 Disperse dye mixtures DYSTAR JAPAN LTD (JP) 1997-07-23 EP disclosed
US-5494493-A DYEING POLYAMIDE AND POLYESTER FIBERS DYSTAR JAPAN LTD. (JP) 1996-02-27 US disclosed
EP-0659841-A2 Disperse dye mixture DyStar Japan Ltd. (JP) 1995-06-28 EP disclosed
US-5332404-A Monoazo dyes and fibers with blends HOECHST MITSUBISHI KASEI CO., LTD. (JP) 1994-07-26 US disclosed
EP-0548715-A1 Disperse dye mixtures DyStar Japan Ltd. (JP) 1993-06-30 EP disclosed