SCHEMBL17774609

SCHEMBL17774609

Nc1ccc(O)cc1S(=O)(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.69
POLB P06746 2/20 0.69
GFER P55789 1/20 0.69
HTR6 P50406 4/20 0.61
TDP1 Q9NUW8 2/20 0.50
ATM Q13315 1/20 0.50
ERAP1 Q9NZ08 1/20 0.50
CDC25B P30305 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
PKM P14618 2/20 0.47
HPGD P15428 1/20 0.47
HKDC1 Q2TB90 1/20 0.43
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
DNMT1 P26358 1/20 0.41
MCL1 Q07820 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL21300501 0.86 GAA (0.64) GAAPOLBGFERHTR6TDP1
SCHEMBL17774538 0.85 CDC25B (0.57) GAAPOLBGFERHTR6TDP1
SCHEMBL17774540 0.83 GAA (0.50) GAAPOLBGFERALDH1A1KDM4E
SCHEMBL29712886 0.81 HTR6 (0.66) GAAPOLBGFERHTR6TDP1
SCHEMBL7559625 0.81 HTR6 (0.66) GAAPOLBGFERHTR6CDC25B
SCHEMBL2862398 0.81 GAA (1.00) GAAPOLBGFERHTR6TDP1
SCHEMBL9070302 0.81 HTR6 (0.66) GAAPOLBGFERHTR6TDP1
SCHEMBL11739876 0.81 HTR6 (0.59) GAAPOLBGFERHTR6TDP1
SCHEMBL17774701 0.81 HTR6 (0.69) GAAPOLBGFERHTR6ALDH1A1
SCHEMBL11212056 0.79 HTR6 (0.61) GAAPOLBGFERHTR6CDC25B

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-9872822-B2 Process for dyeing in the presence of oxidation bases comprising at least one sulfonic, sulfonamide, sulfone, amid or acid group and a metal catalyst, device and ready-to-use composition L'OREAL (FR) 2018-01-23 US disclosed
US-9872822-B2 Process for dyeing in the presence of oxidation bases comprising at least one sulfonic, sulfonamide, sulfone, amid or acid group and a metal catalyst, device and ready-to-use composition L'OREAL (FR) 2018-01-23 US disclosed
US-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION L'OREAL (FR) 2016-05-26 US disclosed
US-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION L'OREAL (FR) 2016-05-26 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-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION KRT18, ARSA, SQOR GAA 872/4885POLB 288/4885GFER 56/4885

“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.