SCHEMBL28823348

SCHEMBL28823348

CC(=O)OOC(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 3/20 0.31
GAA P10253 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
SCHEMBL14752948 0.74 TSHR (0.52) TSHRALDH1A1GAA
SCHEMBL1585487 0.74 TSHR (0.52) TSHRALDH1A1GAA
SCHEMBL29069325 0.74 TSHR (0.39) TSHRALDH1A1
SCHEMBL444118 0.73
SCHEMBL8024288 0.71 ALDH1A1 (0.31) TSHRALDH1A1
SCHEMBL5056434 0.70
SCHEMBL10524610 0.70 TSHR (0.32) TSHRALDH1A1
SCHEMBL28784771 0.69
SCHEMBL6114700 0.67
SCHEMBL28871048 0.66

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-114920874-A Organic bentonite modified oil-absorbing resin and preparation method thereof 中国恩菲工程技术有限公司 2022-08-19 CN claimed
CN-114920874-A Organic bentonite modified oil-absorbing resin and preparation method thereof 中国恩菲工程技术有限公司 2022-08-19 CN disclosed