SCHEMBL29178570

SCHEMBL29178570

C=C(CC)C(=O)OCOC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.33
ALDH1A1 P00352 2/20 0.33
THRB P10828 1/20 0.32
SOAT1 P35610 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
SCHEMBL4619144 0.80 THRB (0.44) TSHRALDH1A1THRBSOAT1
SCHEMBL29178578 0.80 THRB (0.44) TSHRALDH1A1THRBSOAT1
SCHEMBL28063807 0.80 ALDH1A1 (0.42) TSHRALDH1A1THRBSOAT1
SCHEMBL29178571 0.79 TSHR (0.39) TSHRALDH1A1
SCHEMBL23332233 0.78 MGAM (0.39) TSHRALDH1A1
SCHEMBL11291992 0.78 ALOX15 (0.44) TSHRALDH1A1THRBSOAT1
SCHEMBL29178579 0.78 ALDH1A1 (0.31) TSHRALDH1A1THRBSOAT1
SCHEMBL14616313 0.78 THRB (0.31) ALDH1A1THRB
SCHEMBL57345 0.78 THRB (0.50) TSHRALDH1A1THRBSOAT1
SCHEMBL35720 0.78

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-117561385-A Transmission belt 戴科欧洲有限公司 2024-02-13 CN disclosed