SCHEMBL4258191

SCHEMBL4258191

COCOc1ccc(C=Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1OCOC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCOLN3 Q8TDD5 2/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 5/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
USP2 O75604 1/20 0.47
TSHR P16473 4/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
GPBAR1 Q8TDU6 1/20 0.45

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
SCHEMBL4258184 1.00 MCOLN3 (0.48) MCOLN3GAANPSR1HTTALDH1A1
SCHEMBL4257235 0.89 KDM4E (0.50) GAAALDH1A1LMNAUSP2TSHR
SCHEMBL4257232 0.89 KDM4E (0.50) GAAALDH1A1LMNAUSP2TSHR
SCHEMBL4262069 0.84 GPBAR1 (0.64) MCOLN3GAAHTTALDH1A1LMNA
SCHEMBL4262072 0.84 GPBAR1 (0.64) MCOLN3GAAHTTALDH1A1LMNA
SCHEMBL6104113 0.84 KDM4E (0.51) GAAHTTALDH1A1LMNAKMT2A
SCHEMBL6104109 0.84 KDM4E (0.51) GAAHTTALDH1A1LMNAKMT2A
SCHEMBL4270209 0.83 GPBAR1 (0.66) MCOLN3GAAHTTALDH1A1LMNA
SCHEMBL4270211 0.83 GPBAR1 (0.66) MCOLN3GAAHTTALDH1A1LMNA
SCHEMBL4255541 0.79 CA2 (0.55) ALDH1A1KMT2AKDM4E

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-7629375-B2 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2009-12-08 US disclosed
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2006-08-10 US disclosed
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER INC. 2005-06-30 US disclosed
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2005-05-26 US disclosed
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-04-17 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 (4 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-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 MCOLN3 289/4885GAA 251/4885NPSR1 2822/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 MCOLN3 289/4885GAA 251/4885NPSR1 2822/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 MCOLN3 289/4885GAA 251/4885NPSR1 2822/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 MCOLN3 289/4885GAA 251/4885NPSR1 2822/4885

“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.