SCHEMBL2734646

SCHEMBL2734646

Cc1ccccc1S(=O)(=O)CCCCCl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.59
NFE2L2 Q16236 1/20 0.59
ALDH1A1 P00352 8/20 0.38
HTT P42858 2/20 0.38
ALOX12 P18054 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.35
POLB P06746 2/20 0.35
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
PKM P14618 1/20 0.34
TP53 P04637 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2733251 0.98 KEAP1 (0.57) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL2734248 0.98 KEAP1 (0.57) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL2734662 0.98 KEAP1 (0.57) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL14495116 0.87 KEAP1 (0.51) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL8778827 0.84 KEAP1 (0.60) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL7194392 0.82 KEAP1 (0.57) KEAP1NFE2L2ALDH1A1HTTALOX12
SCHEMBL9099317 0.82 KEAP1 (0.59) KEAP1NFE2L2ALDH1A1HTTRAPGEF4
SCHEMBL9102994 0.82 KEAP1 (0.59) KEAP1NFE2L2ALDH1A1HTTRAPGEF4
SCHEMBL8778811 0.82 KEAP1 (0.59) KEAP1NFE2L2ALDH1A1HTTRAPGEF4
SCHEMBL2733953 0.82 KEAP1 (0.59) KEAP1NFE2L2ALDH1A1HTTALOX12

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-20130338110-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS WISCONSIN MED COLLEGE INC (US) 2013-12-19 US disclosed
US-8466130-B2 Mitochondria targeted cationic anti-oxidant compounds for prevention, therapy or treatment of hyper-proliferative disease, neoplasias and cancers COLBY PHARMACEUTICAL COMPANY (US) 2013-06-18 US disclosed
US-20110059922-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS COLBY PHARMACEUTICAL COMPANY (US) 2011-03-10 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 (2 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-20130338110-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS TFAM, HSPD1, NLN KEAP1 982/4885NFE2L2 144/4885ALDH1A1 1738/4885
US-20110059922-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS TFAM, HSPD1, NLN KEAP1 982/4885NFE2L2 144/4885ALDH1A1 1738/4885

“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.