SCHEMBL28199700

SCHEMBL28199700

C=C(C)C([O])=O.CCSS

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 3/20 0.32
THRB P10828 1/20 0.31
TSHR P16473 2/20 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
Methacrylic Acid SCHEMBL331287 0.84 TDP1 (0.35) TDP1ALDH1A1THRBTSHR
SCHEMBL28199699 0.81 TDP1 (0.36) TDP1ALDH1A1THRBTSHR
SCHEMBL28242026 0.78 ALDH1A1 (0.42) TDP1ALDH1A1THRBTSHR
Alcohol SCHEMBL28328891 0.77
SCHEMBL27202 0.76
Hydrochloric Acid SCHEMBL27962103 0.74 BLM (0.39) TDP1ALDH1A1THRBTSHR
SCHEMBL29009355 0.73
SCHEMBL27657707 0.73
SCHEMBL27585829 0.70 TDP1 (0.36) TDP1ALDH1A1THRBTSHR
SCHEMBL27544437 0.70 TDP1 (0.36) TDP1ALDH1A1THRBTSHR

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-107635655-A PEG methacrylate microgel, preparation method and purposes LVMH研究公司 2018-01-26 CN disclosed