SCHEMBL7090751

SCHEMBL7090751

C=C(C)C(=O)OC(C)O.C=CC(=O)N(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL20996780 0.85 TSHR (0.34) TSHRALDH1A1
SCHEMBL9687196 0.83 TSHR (0.42) TSHRALDH1A1
SCHEMBL9515129 0.83 TSHR (0.43) TSHRALDH1A1
Acrylic Acid SCHEMBL4797249 0.82 LMNA (0.40) TSHRALDH1A1
Acrylic Acid SCHEMBL27980475 0.82 LMNA (0.40) TSHRALDH1A1
Butadiene SCHEMBL20577815 0.81 TSHR (0.42) TSHRALDH1A1
SCHEMBL27553112 0.81 TSHR (0.48) TSHRALDH1A1
SCHEMBL10762910 0.81
SCHEMBL20364 0.81
SCHEMBL11125870 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109535345-B Method for preparing polymer based on semi-continuous feeding method 苏州大学 2020-11-17 CN disclosed
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