SCHEMBL17774545

SCHEMBL17774545

Nc1ccc(S(=O)(=O)c2cc(N)ccc2O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HKDC1 Q2TB90 1/20 0.57
▸ HTR6 P50406 4/20 0.56
▸ TSHR P16473 3/20 0.56
▸ LMNA P02545 1/20 0.56
▸ MPO P05164 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ POLB P06746 2/20 0.54
▸ GAA P10253 4/20 0.53
▸ GFER P55789 1/20 0.53
▸ MAPT P10636 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.48
▸ PKM P14618 2/20 0.48
▸ CA12 O43570 3/20 0.48
▸ CA1 P00915 3/20 0.48
▸ CA2 P00918 3/20 0.48
▸ CA9 Q16790 3/20 0.48
▸ CA14 Q9ULX7 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ CA4 P22748 1/20 0.48

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
SCHEMBL7774119 0.93 POLB (0.60) HKDC1HTR6TSHRLMNAMPO
SCHEMBL6322364 0.90 L3MBTL1 (0.57) HKDC1HTR6TSHRLMNAMPO
SCHEMBL17774551 0.89 POLB (0.69) HKDC1HTR6LMNAPOLBGAA
SCHEMBL17774548 0.88 L3MBTL1 (0.48) HKDC1HTR6TSHRLMNAMPO
SCHEMBL7865326 0.85 HKDC1 (0.57) HKDC1HTR6TSHRLMNAMPO
SCHEMBL153129 0.81 HTR6 (0.56) HKDC1HTR6TSHRLMNAMPO
SCHEMBL29388003 0.81 HTR6 (0.56) HKDC1HTR6TSHRLMNAMPO
SCHEMBL17774709 0.80 HTR6 (0.62) HKDC1HTR6TSHRLMNAMPO
SCHEMBL9367132 0.79 CA1 (0.47) HKDC1TSHRCYP3A4CYP2C9POLB
SCHEMBL2118350 0.79 ALDH1A1 (0.55) HKDC1HTR6TSHRLMNAMPO

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 HKDC1 679/4885HTR6 3830/4885TSHR 3932/4885

“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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