SCHEMBL18419447

SCHEMBL18419447

Nc1ccc(C(=O)Nc2ccc3cc(S(=O)(=O)O)cc(OCCCCS(=O)(=O)O)c3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.56
▸ CTDSP1 Q9GZU7 1/20 0.56
▸ ENPP2 Q13822 5/20 0.48
▸ NT5E P21589 2/20 0.43
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TP53 P04637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PRMT1 Q99873 3/20 0.39

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
SCHEMBL18419441 0.97 CASP6 (0.57) CASP6CTDSP1ENPP2NT5ECA12
SCHEMBL18419457 0.93 CASP6 (0.62) CASP6CTDSP1ENPP2NT5ECA12
SCHEMBL18419442 0.90 CASP6 (0.64) CASP6CTDSP1ENPP2CA12CA1
SCHEMBL18419444 0.88 CASP6 (0.43) CASP6CTDSP1ENPP2NT5EMEN1
SCHEMBL18419440 0.87 CASP6 (0.44) CASP6CTDSP1ENPP2NT5ELMNA
SCHEMBL18419436 0.87 CASP6 (0.47) CASP6CTDSP1ENPP2NT5ECA12
SCHEMBL18419449 0.85 CASP6 (0.43) CASP6CTDSP1ENPP2NT5EMEN1
SCHEMBL18419458 0.84 CASP6 (0.45) CASP6CTDSP1ENPP2NT5ELMNA
SCHEMBL18419451 0.84 CASP6 (0.48) CASP6CTDSP1ENPP2NT5ECA12
SCHEMBL19175268 0.84 ENPP2 (0.54) CASP6CTDSP1ENPP2NT5EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10150871-B2 Azo compound, dye-based polarizing film containing same, and polarizing plate NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2018-12-11 — — US disclosed
US-20170210902-A1 Azo Compound, Dye-Based Polarizing Film Containing Same, And Polarizing Plate NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2017-07-27 — — US disclosed
EP-3127965-A1 AZO COMPOUND, DYE-BASED POLARIZING FILM CONTAINING SAME, AND POLARIZING PLATE Nippon Kayaku Kabushiki Kaisha (JP) 2017-02-08 — — EP disclosed
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