SCHEMBL6282566

SCHEMBL6282566

CC(C)(CO)c1ccc(CNS(=O)(=O)c2cccnc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 5/20 0.57
▸ SLC2A1 P11166 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPT P10636 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ PAX8 Q06710 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL6276329 0.87 NAMPT (0.68) NAMPTSLC2A1ALDH1A1MAPTLMNA
SCHEMBL6281607 0.84 NAMPT (0.59) NAMPTSLC2A1ALDH1A1MAPTLMNA
SCHEMBL28413113 0.79 NAMPT (0.64) NAMPTALDH1A1LMNASMN1; SMN2PKM
SCHEMBL6283652 0.79 HDAC3 (0.47) NAMPTSLC2A1ALDH1A1
SCHEMBL18725052 0.78 KEAP1 (0.71) NAMPTMAPTLMNASMN1; SMN2PAX8
SCHEMBL750261 0.77 MEN1 (0.58) NAMPTMAPTLMNASMN1; SMN2PAX8
SCHEMBL533757 0.77 LMNA (0.56) NAMPTALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL15651151 0.77 CA12 (0.59) NAMPTALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL12982562 0.76 POLB (0.53) NAMPTSLC2A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL534569 0.76 LMNA (0.63) NAMPTLMNASMN1; SMN2PAX8POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852863-B2 Metabolites of (3-{[4-tert-butyl-benzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid PFIZER INC. (US) 2005-02-08 — — US claimed
EP-1470109-A1 METABOLITES OF (3- [(4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO]-METHYL -PHENOXY)-ACETIC ACID Pfizer Products Inc. (US) 2004-10-27 — — EP claimed
US-20030216445-A1 Metabolites of (3-[[4-tert-butyl-benzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid CAMERON KIMBERLY O (US) 2003-11-20 — — US claimed
WO-2003064391-A1 METABOLITES OF (3-{[4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO]-METHYL}-PHENOXY)-ACETIC ACID PFIZER PRODUCTS INC. (US) 2003-08-07 — — WO claimed
US-6852863-B2 Metabolites of (3-{[4-tert-butyl-benzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid PFIZER INC. (US) 2005-02-08 — — US disclosed
EP-1470109-A1 METABOLITES OF (3- [(4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO]-METHYL -PHENOXY)-ACETIC ACID Pfizer Products Inc. (US) 2004-10-27 — — EP disclosed
US-20030216445-A1 Metabolites of (3-[[4-tert-butyl-benzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid CAMERON KIMBERLY O (US) 2003-11-20 — — US disclosed
WO-2003064391-A1 METABOLITES OF (3-{[4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO]-METHYL}-PHENOXY)-ACETIC ACID PFIZER PRODUCTS INC. (US) 2003-08-07 — — WO 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-20030216445-A1 Metabolites of (3-[[4-tert-butyl-benzyl)-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid ABAT, BCAT2, PC NAMPT 2536/4885SLC2A1 2029/4885ALDH1A1 128/4885

“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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