SCHEMBL4176256

SCHEMBL4176256

O=C1C(=O)c2ccc3ccccc3c2C(S(=O)(=O)O)=C1S(=O)(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CES1 P23141 3/20 0.42
▸ NSD2 O96028 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.40
▸ WDR5 P61964 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 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
SCHEMBL19230420 0.80 DNMT1 (0.73) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL11062392 0.78 DNMT1 (0.47) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL11052751 0.78 NSD2 (0.51) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL7122517 0.76 DNMT1 (0.73) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL30362207 0.76 DNMT1 (0.67) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL12236188 0.76 DNMT1 (0.67) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL19230424 0.74 DNMT1 (0.78) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL9900718 0.74 DNMT1 (0.70) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL19230419 0.73 DNMT1 (0.83) DNMT1ALDH1A1MEN1KMT2AMAPT
SCHEMBL16144669 0.72 DNMT1 (0.68) DNMT1ALDH1A1MEN1KMT2AMAPT

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-20090104417-A1 Magenta Dyes and Their Use in Ink-Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-04-23 — — US disclosed
WO-2006125951-A2 MAGENTA DYES AND THEIR USE IN INK-JET PRINTING FUJIFILM IMAGING COLORANTS LIMITED (GB) 2006-11-30 — — WO disclosed
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