SCHEMBL5153341

SCHEMBL5153341

O=S(=O)(c1cc(O)c(O)c(O)c1)c1cccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 3/20 0.57
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ HCRTR1 O43613 1/20 0.48
▸ ALPL P05186 1/20 0.46
▸ ALPI P09923 1/20 0.46
▸ ALPG P10696 1/20 0.46
▸ DNMT1 P26358 1/20 0.46
▸ MCL1 Q07820 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ PRSS2 P07478 1/20 0.45
▸ PRSS3 P35030 1/20 0.45
▸ HKDC1 Q2TB90 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ PFKFB3 Q16875 1/20 0.44

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
SCHEMBL9645034 0.85 HTR6 (0.59) HTR6CA1CA2CA9HCRTR1
SCHEMBL3406414 0.81 CA1 (0.50) HTR6CA1CA2CA9HCRTR1
SCHEMBL6828570 0.79 HTR6 (0.70) HTR6CA1CA2CA9HCRTR1
SCHEMBL7190517 0.79 CA1 (0.60) HTR6CA1CA2CA9HCRTR1
SCHEMBL3249669 0.78 HTR6 (0.73) HTR6CA1CA2CA9F2
SCHEMBL547461 0.78 CA1 (0.68) HTR6CA1CA2CA9HCRTR1
SCHEMBL7139532 0.77 HTR6 (0.57) HTR6CA1CA2CA9F2
Pyrogallol SCHEMBL28731616 0.76 CA1 (0.56) HTR6CA1CA2CA9HCRTR1
SCHEMBL7175789 0.76 CA1 (0.65) HTR6CA1CA2CA9HCRTR1
SCHEMBL7196896 0.75 ALPL (0.61) HTR6CA1CA2CA9HCRTR1

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
EP-1245403-B1 Thermographic recording material with improved image tone. AGFA GEVAERT (BE) 2007-01-03 — — EP disclosed
US-6774084-B2 BLACK AND WHITE LIGHT-INSENSITIVE THERMOGRAPHIC RECORDING MEDIA COMPRISING A THERMOSENSITIVE ELEMENT HAVING ORGANIC SILVER SALT, A 1,2-DIHYDROXYBENZENE CONTAINING AN ESTER OR SULFOXIDE GROUP AND BINDER; COVERING POWER; STORAGE STABILITY AGFA-GEVAERT (BE) 2004-08-10 — — US disclosed
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