SCHEMBL2797281

SCHEMBL2797281

CON(c1ccccc1)S(=O)(=O)c1ccc(C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
PKM P14618 1/20 0.41
ESR1 P03372 4/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP2A6 P11509 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
PGR P06401 1/20 0.38

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
SCHEMBL6792747 0.82 PKM (0.58) ALDH1A1CA12CA9PKMESR1
SCHEMBL2801033 0.79 CA12 (0.67) CA12CA9TSHRKMT2ALMNA
SCHEMBL11405331 0.78 ALDH1A1 (0.51) ALDH1A1CA12CA9PKMESR1
SCHEMBL5459206 0.75 PTGES (0.46) ALDH1A1ESR1TSHRMAPK1LMNA
SCHEMBL6158839 0.74 ALDH1A1 (0.59) ALDH1A1CA12CA9PKMESR1
SCHEMBL25412643 0.72 HDAC1 (0.61) ALDH1A1CA12CA9TSHRKMT2A
SCHEMBL9954268 0.71 KEAP1 (0.48) ALDH1A1KMT2A
SCHEMBL847553 0.70 LMNA (0.58) ALDH1A1KMT2ACYP2A6LMNAHTT
SCHEMBL11549193 0.70 ALDH1A1 (0.44) ALDH1A1CA12CA9PKMKMT2A
SCHEMBL3565963 0.69 ALDH1A1 (0.64) ALDH1A1PKMMAPK1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168112-A1 2-Substituted and 4-substituted aryl nitrone compounds RENOVIS, INC. 2010-07-01 US disclosed
EP-1753714-A4 2-SUBSTITUTED AND 4-SUBSTITUTED ARYL NITRONE COMPOUDS RENOVIS INC (US) 2007-10-17 EP disclosed
EP-1753714-A2 2-SUBSTITUTED AND 4-SUBSTITUTED ARYL NITRONE COMPOUDS Renovis, Inc. (US) 2007-02-21 EP disclosed
WO-2005079270-A2 2-SUBSTITUTED AND 4-SUBSTITUTED ARYL NITRONE COMPOUDS RENOVIS, INC. (US) 2005-09-01 WO disclosed
US-20050182060-A1 2-Substituted and 4-substituted aryl nitrone compounds RENOVIS, INC. 2005-08-18 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-20100168112-A1 2-Substituted and 4-substituted aryl nitrone compounds CXCR2, CCL5, CCL2 ALDH1A1 226/4885CA12 3508/4885CA9 3281/4885
US-20050182060-A1 2-Substituted and 4-substituted aryl nitrone compounds CXCR2, CCL5, CCL2 ALDH1A1 226/4885CA12 3508/4885CA9 3281/4885

“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.