SCHEMBL3089972

SCHEMBL3089972

O=Nc1cc(S(=O)(=O)O)cc(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ ING2 Q9H160 1/20 0.41
▸ POLB P06746 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ TSHR P16473 3/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ LMNA P02545 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ NT5E P21589 3/20 0.36
▸ HSD17B10 Q99714 5/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ CASP6 P55212 3/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ NSD2 O96028 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ PLCG1 P19174 1/20 0.33
▸ DNMT1 P26358 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL219222 0.81 LCK (0.57) LCKFYNING2POLBCYP2D6
SCHEMBL5013229 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
SCHEMBL216136 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
SCHEMBL9220939 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
Hydrochloric Acid SCHEMBL9775388 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
Hydrochloric Acid SCHEMBL23302213 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
SCHEMBL124133 0.78 LCK (0.55) LCKFYNING2POLBCYP2D6
SCHEMBL3876794 0.78 TSHR (0.53) POLBCYP2D6TSHRSMN1; SMN2ALDH1A1
SCHEMBL3872941 0.75 POLB (0.59) ING2POLBCYP2D6TSHRSMN1; SMN2
SCHEMBL13749422 0.75 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799122-B2 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-09-21 — — US disclosed
US-20100151212-A1 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-06-17 — — US disclosed
EP-1913091-B1 AZO COMPOUNDS FUJIFILM IMAGING COLORANTS LTD (GB) 2009-04-22 — — EP disclosed
EP-1913091-A2 AZO COMPOUNDS FUJIFILM Imaging Colorants Limited (GB) 2008-04-23 — — EP disclosed
WO-2007135361-A2 COLORANTS FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-11-29 — — WO disclosed
WO-2007012828-A2 AZO COMPOUNDS FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-02-01 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100151212-A1 Azo compounds PAH, CYP1A1, RB1 LCK 3094/4885FYN 2587/4885ING2 394/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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