SCHEMBL1265713

SCHEMBL1265713

O=C(O)c1cc(=O)n(-c2ccc(CCCS(=O)(=O)O)cc2)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 17/20 0.60
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MME P08473 1/20 0.36

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
SCHEMBL1266940 0.80 ALKBH5 (0.63) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL67421 0.77 ALKBH5 (0.66) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL9619302 0.77 ALKBH5 (0.58) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL697599 0.74 MAPT (0.57) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL692998 0.73 ALKBH5 (0.64) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL11579812 0.73 ALKBH5 (0.53) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL11578805 0.73 ALKBH5 (0.53) ALKBH5ALDH1A1
SCHEMBL951472 0.73 ALKBH5 (0.73) ALKBH5ALDH1A1MAPT
SCHEMBL10787351 0.72 ALKBH5 (0.71) ALKBH5KDM4EALDH1A1MAPTKMT2A
SCHEMBL9505312 0.72 ALKBH5 (1.00) ALKBH5KDM4EALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7988740-B2 Keratin dyeing compositions comprising a radical scavenger and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-08-02 US claimed
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof NOXELL CORPORATION 2011-02-17 US claimed
US-7988740-B2 Keratin dyeing compositions comprising a radical scavenger and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-08-02 US disclosed
US-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof NOXELL CORPORATION 2011-02-17 US 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-20110035885-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and Use Thereof KRT18, LPO, CYB5R3 ALKBH5 413/4885KDM4E 841/4885ALDH1A1 326/4885

“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.