SCHEMBL6038801

SCHEMBL6038801

CC(C)c1ccc(S([NH])(=O)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 3/20 0.50
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.44
TYR P14679 2/20 0.43
PGR P06401 1/20 0.42
KAT6A Q92794 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
PKM P14618 2/20 0.40
POLB P06746 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40

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
SCHEMBL29618 0.81 ALDH1A1 (0.56) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL11850699 0.80 LMNA (0.70) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL7044927 0.79 ALDH1A1 (0.54) ALDH1A1MAPTLMNAKDM4EGAA
Hydrochloric Acid SCHEMBL2245621 0.79 ALDH1A1 (0.54) ALDH1A1MAPTLMNAKDM4EGAA
Ammonia Solution, Strong SCHEMBL340601 0.79 ALDH1A1 (0.54) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL2281688 0.79 ALDH1A1 (0.48) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL458667 0.78 ALDH1A1 (0.52) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL7866855 0.78 ENPP2 (0.52) ALDH1A1MAPTLMNAKDM4EGAA
Potassium Ion SCHEMBL8632105 0.77 ALDH1A1 (0.52) ALDH1A1MAPTLMNAKDM4EGAA
SCHEMBL12014080 0.77 CA12 (0.50) ALDH1A1MAPTLMNAKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004010-A1 Ccr4 antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1541563-A1 CCR4 ANTAGONIST AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-06-15 EP disclosed
US-5389620-A Bronchodilation agent, vasodilation BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-02-14 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-20060004010-A1 Ccr4 antagonist and medical use thereof CCR4, CCR1, CCR9 ALDH1A1 2902/4885MAPT 3473/4885LMNA 4821/4885

“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.