SCHEMBL9652106

SCHEMBL9652106

O=S(=O)(Oc1ccc(-c2ccccc2)cc1)c1cc[c]cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.54
▸ CA2 P00918 8/20 0.54
▸ CA12 O43570 7/20 0.54
▸ CA1 P00915 2/20 0.53
▸ CA9 Q16790 2/20 0.53
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ APEX1 P27695 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ ADAMTS4 O75173 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ PARL Q9H300 1/20 0.45
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL28456945 0.93 TDP1 (0.59) TDP1CA2CA12CA1CA9
SCHEMBL6882273 0.89 TDP1 (0.56) TDP1CA2CA12CA1CA9
SCHEMBL2058543 0.87 TDP1 (0.69) TDP1CA2CA12CA1CA9
SCHEMBL687580 0.85 TDP1 (0.61) TDP1CA2CA12CA1CA9
SCHEMBL8442031 0.83 TDP1 (0.58) TDP1CA2CA12CA1CA9
SCHEMBL10950314 0.83 TDP1 (0.58) TDP1CA2CA12CA1CA9
SCHEMBL21409343 0.83 TDP1 (0.59) TDP1CA2CA12CA1CA9
Biphenyl SCHEMBL28818524 0.81 TDP1 (0.66) TDP1CA2CA12CA1CA9
SCHEMBL24604538 0.79 CA2 (0.62) TDP1CA2CA12CA1CA9
SCHEMBL8602840 0.79 TDP1 (0.54) TDP1CA2CA12CA1CA9

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-0360085-B1 OFFSET PRINTING AND OFFSET DYESTUFFS BAYER AG (DE) 1992-12-09 — — EP disclosed
EP-0360085-A2 Offset printing and offset dyestuffs BAYER AG (DE) 1990-03-28 — — EP disclosed
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