SCHEMBL28358706

SCHEMBL28358706

C=C(C)C(=O)OC(CCC)OOC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 3/20 0.34
THRB P10828 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
SCHEMBL28537932 0.83 TSHR (0.32) TSHR
SCHEMBL142824 0.82 ALDH1A1 (0.46) ALDH1A1TSHRTHRB
SCHEMBL21433582 0.82
SCHEMBL21433578 0.82
SCHEMBL28354007 0.80 CTSS (0.35)
SCHEMBL464897 0.78 TSHR (0.39) TSHRTHRB
SCHEMBL9418607 0.78 TSHR (0.35) TSHRTHRB
SCHEMBL28354355 0.78 SMPD1 (0.36) ALDH1A1TSHRTHRB
SCHEMBL2883505 0.78 PRKCA (0.36)
SCHEMBL28993876 0.78 ALDH1A1 (0.41) ALDH1A1TSHRTHRB

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
CN-110790870-A Modified hydroxyl acrylic resin, preparation method and modified hydroxyl acrylic ester coating 恒昌涂料(惠阳)有限公司 2020-02-14 CN disclosed