SCHEMBL9437852

SCHEMBL9437852

O=C(O)C(O)C(OS(=O)(=O)S)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
PGD P52209 1/20 0.32

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
SCHEMBL20742048 0.81 TSHR (0.43) TSHRPGD
SCHEMBL1794070 0.79 TSHR (0.41) TSHR
SCHEMBL3634910 0.77 TSHR (0.39) TSHRPGD
Benzene SCHEMBL9474100 0.76 TSHR (0.38) TSHR
SCHEMBL4607776 0.70 LMNA (0.32) TSHR
SCHEMBL915072 0.69 TSHR (0.53) TSHRPGD
Cadaverine Tartrate SCHEMBL28789883 0.67 TSHR (0.59) TSHR
SCHEMBL1068276 0.67 TSHR (0.50) TSHRPGD
SCHEMBL20839610 0.67 TSHR (0.50) TSHRPGD
SCHEMBL7516069 0.65 TSHR (0.47) TSHRPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5344464-A Hair dyes with para-phenylenediamine and N,N*-diphenyl-alkylenediamine dye precursors for keratin fibers L'OREAL (FR) 1994-09-06 US disclosed
US-5137538-A P-Phenylenediamine and N,N'-diphenylalkylenediamines; uniform color on bleached or permed hair L'OREAL (FR) 1992-08-11 US disclosed