SCHEMBL28515491

SCHEMBL28515491

CO[SiH](CCCCOC(C)CC1CO1)OC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL28522983 0.95
SCHEMBL28522634 0.85 ALDH1A1 (0.32) TSHRALDH1A1TDP1
SCHEMBL11324706 0.74 TSHR (0.34) TSHRALDH1A1TDP1
SCHEMBL28516801 0.74
SCHEMBL28065 0.73 TSHR (0.64) TSHRALDH1A1TDP1
SCHEMBL5605970 0.73 ALDH1A1 (0.33) TSHRALDH1A1TDP1
SCHEMBL23706450 0.72 TSHR (0.62) TSHRALDH1A1TDP1
SCHEMBL23706437 0.72 TSHR (0.62) TSHRALDH1A1TDP1
SCHEMBL23706445 0.72 TSHR (0.62) TSHRALDH1A1TDP1
SCHEMBL23706411 0.72 TSHR (0.62) TSHRALDH1A1TDP1

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-107960095-B Coating composition and optical member 日产化学工业株式会社 2021-02-02 CN disclosed