SCHEMBL28935256

SCHEMBL28935256

C(COCC1CO1)CSSCCCOCC1CO1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.71
SMN1; SMN2 Q16637 2/20 0.61
ALDH1A1 P00352 5/20 0.57
TDP1 Q9NUW8 2/20 0.57
MAPK1 P28482 1/20 0.42
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PDK1 Q15118 1/20 0.32
HIF1A Q16665 1/20 0.31

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
SCHEMBL6056058 0.87 TSHR (0.71) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL18470518 0.86 TSHR (0.62) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL6245334 0.85 TSHR (0.68) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL100304 0.84 TSHR (0.90) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL21272 0.84 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL13974192 0.84 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL24547426 0.84 TSHR (0.90) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL17549552 0.84 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL6244654 0.83 TSHR (0.65) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL14214398 0.83 TSHR (0.65) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1

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-113122032-B Primer composition and laminate 财团法人工业技术研究院 2022-03-15 CN claimed