SCHEMBL7092359

SCHEMBL7092359

C=C(C)C(=O)OC(C)OC.C=C(C)C(=O)OC(C)OCC

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 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
SCHEMBL36100 0.93 TSHR (0.45) TSHRALDH1A1LMNATHRB
Dimethylamine SCHEMBL8149526 0.87 TSHR (0.41) TSHRALDH1A1LMNATHRB
SCHEMBL137981 0.87 ALDH1A1 (0.50) TSHRALDH1A1THRB
SCHEMBL10605722 0.86 TSHR (0.38) TSHRALDH1A1LMNATHRB
SCHEMBL1760780 0.84 TSHR (0.41) TSHRALDH1A1LMNATHRB
Acrylic Acid SCHEMBL27777253 0.83 TSHR (0.38) TSHRALDH1A1LMNATHRB
SCHEMBL28369868 0.82 TSHR (0.40) TSHRALDH1A1LMNATHRB
SCHEMBL27620036 0.81 ALDH1A1 (0.62) TSHRALDH1A1THRB
Methacrylic Acid SCHEMBL28142674 0.81 ALDH1A1 (0.44) TSHRALDH1A1THRB
SCHEMBL10804891 0.81 TSHR (0.46) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0195108-B1 EMBEDDING MEDIUM SUITABLE FOR THE PREPARATION OF THIN SECTIONS OF EMBEDDED BIOLOGICAL MATERIALS Chemische Werke Lowi Beteiligungs GmbH (DE) 1989-08-16 EP claimed
US-4680362-A Embedding media suitable for the preparation of thin sections of embedded biological materials CHEMISCHE WERKE LOWI GMBH (DE) 1987-07-14 US claimed
US-20030010668-A1 Desiccating container for moisture-sensitive material WEST PHARMACEUTICAL SERVICES, INC. 2003-01-16 US disclosed
US-5947274-A Desiccating container for moisture-sensitive material SMITHKLINE BEECHAM P.L.C. (GB) 1999-09-07 US disclosed
EP-0195108-B1 EMBEDDING MEDIUM SUITABLE FOR THE PREPARATION OF THIN SECTIONS OF EMBEDDED BIOLOGICAL MATERIALS Chemische Werke Lowi Beteiligungs GmbH (DE) 1989-08-16 EP disclosed
US-4680362-A Embedding media suitable for the preparation of thin sections of embedded biological materials CHEMISCHE WERKE LOWI GMBH (DE) 1987-07-14 US disclosed