SCHEMBL4760195

SCHEMBL4760195

C=CC(=O)C(CS(=O)(=O)O)N(C)C.C=CC(=O)OCCO

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.51
HPGD P15428 1/20 0.37
ALDH1A1 P00352 4/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
CYP3A4 P08684 2/20 0.37
HSD17B10 Q99714 1/20 0.37
THRB P10828 2/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL29554649 0.87 TSHR (0.49) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL94258 0.84
Ammonia Solution, Strong SCHEMBL2802434 0.82
SCHEMBL29642706 0.82
SCHEMBL4760194 0.80 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
Acrylamide SCHEMBL30508942 0.78 ALDH1A1 (0.37) TSHRALDH1A1
Acrylic Acid SCHEMBL4760578 0.77
Sulfuric Acid SCHEMBL1683520 0.75 TSHR (0.83) TSHRHPGDALDH1A1TP53HIF1A
Trimethylammonium SCHEMBL9145191 0.75 TSHR (0.83) TSHRHPGDALDH1A1TP53HIF1A
Methacrylic Acid SCHEMBL29429657 0.74

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107281033-A Sleep mask of acne scar acne print and its preparation method and application can be repaired 李剑峰 2017-10-24 CN claimed
CN-107280988-A Resveratrol cyclodextrin inclusion compound, oligopeptide facial mask liquid and preparation method thereof 李剑峰 2017-10-24 CN disclosed
CN-107281033-A Sleep mask of acne scar acne print and its preparation method and application can be repaired 李剑峰 2017-10-24 CN disclosed
US-8579992-B2 Hair dye FUJIFILM CORPORATION (JP) 2013-11-12 US disclosed
US-20130232701-A1 HAIR DYE FUJIFILM CORPORATION (JP) 2013-09-12 US disclosed
JP-2008019203-A ACID HAIR DYE COMPOSITION HOYU CO LTD 2008-01-31 JP disclosed
JP-2007308393-A HAIR COATING COMPOSITION HOYU CO LTD 2007-11-29 JP disclosed