SCHEMBL16838445

SCHEMBL16838445

CNc1ccc2c(OC)c(/N=N/c3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3O)c(S(=O)(=O)O)cc2c1/N=N/c1cc(S(=O)(=O)CCOS(=O)(=O)O)ccc1OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ PRMT1 Q99873 1/20 0.39
▸ ENPP2 Q13822 5/20 0.38
▸ PTPN1 P18031 2/20 0.35
▸ MAPK1 P28482 2/20 0.33
▸ MITF O75030 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ MPL P40238 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ PHLPP2 Q6ZVD8 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
SCHEMBL16838507 0.94 PRMT1 (0.41) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838432 0.93 PRMT1 (0.37) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838449 0.93 ENPP2 (0.34) TDP1MEN1KMT2APRMT1ENPP2
SCHEMBL16838522 0.90 ENPP2 (0.37) TDP1MEN1KMT2AENPP2MAPK1
SCHEMBL18684967 0.89 ENPP2 (0.42) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838434 0.89 ENPP2 (0.34) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838423 0.89 PRMT1 (0.34) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838475 0.88 ENPP2 (0.33) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838518 0.88 ENPP2 (0.34) TDP1MEN1KMT2AKDM4EMAPT
SCHEMBL16838479 0.88 ENPP2 (0.34) TDP1MEN1KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9062208-B2 Fiber-reactive copper complex disazo dyes DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-06-23 — — US disclosed
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