SCHEMBL28529660

SCHEMBL28529660

C=C(C)C(=O)OC1C(C(C)(C)C)C(C)(C)N(C)C(C)(C)C1C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 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
SCHEMBL9883026 0.69 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL8866100 0.67
SCHEMBL67638 0.66 TSHR (0.39) ALDH1A1TSHR
SCHEMBL8854706 0.66 TSHR (0.39) ALDH1A1TSHR
SCHEMBL1703068 0.65 KMT2A (0.32) ALDH1A1TSHR
SCHEMBL28529659 0.64
SCHEMBL14816291 0.64 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL14816289 0.64 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL14816334 0.64 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL21158790 0.64 ALDH1A1 (0.50) ALDH1A1TSHR

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
CN-112272687-B Phosphate amine salt composition, phosphate amine salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2022-06-10 CN disclosed
CN-112839988-A Nucleating agent, synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2021-05-25 CN disclosed
CN-112368339-A Additive composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2021-02-12 CN disclosed
CN-112292426-A Polyphosphate salt composition, polyphosphate salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2021-01-29 CN disclosed
CN-112272687-A Amine phosphate salt composition, amine phosphate salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2021-01-26 CN disclosed