SCHEMBL2801005

SCHEMBL2801005

CC(C)(C)NS(=O)(=O)c1ccccc1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 2/20 0.47
BRD4 O60885 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
THRB P10828 1/20 0.43
BLM P54132 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PARG Q86W56 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 1/20 0.41
ALOX5AP P20292 5/20 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
SCHEMBL17680243 0.82 BRD4 (0.48) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL2803354 0.82 NSD2 (0.58) NSD2SMN1; SMN2MEN1LMNAKMT2A
SCHEMBL2798389 0.81 LMNA (0.46) SMN1; SMN2MEN1LMNAKMT2AHPGD
SCHEMBL17680837 0.81 BRD4 (0.47) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL19531675 0.81 BRD4 (0.47) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL19538961 0.78 BRD4 (0.46) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL20746862 0.78 BRD4 (0.46) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL19538860 0.78 BRD4 (0.46) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL2798321 0.77 NSD2 (0.41) NSD2BRD4SMN1; SMN2MEN1LMNA
SCHEMBL13232916 0.77 NSD2 (0.41) NSD2BRD4SMN1; SMN2MEN1LMNA

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 NSD2 2837/4885BRD4 934/4885SMN1; SMN2 1311/4885
US-20050182060-A1 2-Substituted and 4-substituted aryl nitrone compounds CXCR2, CCL5, CCL2 NSD2 2837/4885BRD4 934/4885SMN1; SMN2 1311/4885

“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.