SCHEMBL29138974

SCHEMBL29138974

C=C(C)C(=O)OP(=O)(O)OC(O)CO

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 2/20 0.33
THRB P10828 1/20 0.30

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
SCHEMBL27565567 0.80 TSHR (0.38) TSHRALDH1A1
SCHEMBL28383299 0.78 TSHR (0.39) TSHRALDH1A1
SCHEMBL20674 0.77 SMN1; SMN2 (0.38) TSHRALDH1A1
SCHEMBL9276375 0.77 ALDH1A1 (0.48) TSHRALDH1A1THRB
Phosphoric Acid SCHEMBL27689168 0.77 TSHR (0.38) TSHRALDH1A1THRB
SCHEMBL5557883 0.76 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL3323367 0.75 TSHR (0.37) TSHRALDH1A1
Propylene Glycol SCHEMBL7578657 0.75 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL2567133 0.74 ALDH1A1 (0.38) TSHRALDH1A1THRB
SCHEMBL28345358 0.74 TSHR (0.40) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117401925-A Crystal nucleus reinforcing agent, cementing material and preparation method thereof 中国科学院深圳先进技术研究院 2024-01-16 CN claimed
CN-117401925-A Crystal nucleus reinforcing agent, cementing material and preparation method thereof 中国科学院深圳先进技术研究院 2024-01-16 CN disclosed