SCHEMBL5720482

SCHEMBL5720482

CCOC(=O)Nc1ccc2c(O)cc(S(=O)(=O)O)cc2c1S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ PRMT1 Q99873 1/20 0.45
▸ NLRP3 Q96P20 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ NT5E P21589 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ CASP6 P55212 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ MMP12 P39900 2/20 0.39
▸ MMP13 P45452 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
SCHEMBL10509094 0.84 PRMT1 (0.48) SMN1; SMN2PRMT1ALDH1A1POLBNT5E
SCHEMBL1803722 0.82 CASP6 (0.52) PRMT1ALDH1A1HPGDPOLBNT5E
SCHEMBL5720500 0.81 PRMT1 (0.67) CYP1A2CYP2C9CYP2C19SMN1; SMN2PRMT1
SCHEMBL5720569 0.80 TIMP3 (0.46) CYP1A2CYP2C9CYP2C19SMN1; SMN2PRMT1
SCHEMBL28785155 0.79 NLRP3 (0.56) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL11036814 0.78 PRMT1 (0.48) CYP2C9CYP2C19PRMT1ALDH1A1HPGD
SCHEMBL5720540 0.77 NT5E (0.65) CYP1A2CYP2C9CYP2C19SMN1; SMN2PRMT1
SCHEMBL5720688 0.76 NT5E (0.45) CYP1A2CYP2C9CYP2C19SMN1; SMN2PRMT1
SCHEMBL7901329 0.76 APEX1 (0.60) CYP1A2PRMT1ALDH1A1HPGDPOLB
SCHEMBL9696584 0.75 PRMT1 (0.48) CYP2C9CYP2C19PRMT1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060229440-A1 Disazo dyes, and copper complexes thereof, for dyeing paper KASER ADOLF 2006-10-12 — — US disclosed
US-7078497-B2 Disazo dyes, and copper complexes thereof, for dyeing paper CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-07-18 — — US disclosed
EP-1345992-B1 DISAZO DYES, AND COPPER COMPLEXES THEREOF, FOR DYEING PAPER CIBA SC HOLDING AG (CH) 2006-07-05 — — EP disclosed
US-20040063920-A1 Disazo dyes, and copper complexes thereof, for dyeing paper CIBA SPECIALTY CHEMICALS CORP. 2004-04-01 — — US disclosed
CN-1483063-A Disazo dyes and copper complexes thereof for dyeing paper �������⻯ѧƷ�ع����޹�˾ 2004-03-17 — — CN disclosed
EP-1345992-A2 DISAZO DYES, AND COPPER COMPLEXES THEREOF, FOR DYEING PAPER Ciba SC Holding AG (CH) 2003-09-24 — — EP disclosed
WO-2002053649-A2 DISAZO DYES, AND COPPER COMPLEXES THEREOF, FOR DYEING PAPER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-07-11 — — 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-20060229440-A1 Disazo dyes, and copper complexes thereof, for dyeing paper AOC1, SOD1, AOC3 CYP1A2 317/4885CYP2C9 63/4885CYP2C19 276/4885

“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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