SCHEMBL29001043

SCHEMBL29001043

C=C(C(=O)OC)C(C)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CA14 Q9ULX7 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 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
SCHEMBL4710209 0.79 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL14749828 0.79 ALDH1A1 (0.44) ALDH1A1CA14TSHR
SCHEMBL1895280 0.76
SCHEMBL11318092 0.76 ALDH1A1 (0.41) ALDH1A1
SCHEMBL6054550 0.75 TDP1 (0.43) TDP1
SCHEMBL3909058 0.75
SCHEMBL599284 0.73
SCHEMBL3859257 0.73
Ammonia Solution, Strong SCHEMBL28843678 0.73 ALDH1A1 (0.48) ALDH1A1CA14TSHR
SCHEMBL14334528 0.73 SLC7A5 (0.36) TDP1

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-109666163-B Hybrid crosslinked dynamic polymer and application thereof 厦门逍扬运动科技有限公司 2023-05-12 CN disclosed