SCHEMBL28309236

SCHEMBL28309236

C=CC(=CC)C(=O)OC(=O)C(C=C)C=C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
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
SCHEMBL28041979 0.80 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL25433508 0.73
SCHEMBL8591891 0.72 TSHR (0.41) TSHRALDH1A1
SCHEMBL28431641 0.70 TSHR (0.43) TSHRALDH1A1
SCHEMBL15606841 0.69
SCHEMBL27910176 0.69
SCHEMBL27282486 0.68 NPSR1 (0.43) TSHRALDH1A1
SCHEMBL7693237 0.68 NPSR1 (0.43) TSHRALDH1A1
SCHEMBL896154 0.67 ALDH1A1 (0.35) ALDH1A1
SCHEMBL28251454 0.67 ALDH1A1 (0.35) ALDH1A1

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-105593291-B Resin combination, multilayer structure making and the thermoformed containers formed by multilayer structure making 株式会社可乐丽 2019-07-05 CN disclosed