SCHEMBL829587

SCHEMBL829587

CS(=O)(=O)Nc1c(OC(=O)Oc2ccc3ccccc3c2NS(C)(=O)=O)ccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.48
G6PD P11413 1/20 0.48
KEAP1 Q14145 1/20 0.47
HKDC1 Q2TB90 1/20 0.45
NCEH1 Q6PIU2 10/20 0.44
LMNA P02545 1/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
HSD17B2 P37059 1/20 0.42
ALDH1A1 P00352 1/20 0.41
PGR P06401 1/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL829594 0.81 SMN1; SMN2 (0.61) HCRTR1NCEH1LMNAALDH1A1GAA
SCHEMBL829952 0.80 G6PD (0.71) HCRTR1G6PDKEAP1HKDC1HSD17B2
SCHEMBL829711 0.78 RAB9A (0.42) HCRTR1G6PDKEAP1NCEH1LMNA
SCHEMBL830308 0.78 LMNA (0.50) G6PDNCEH1LMNAALDH1A1MAPK1
SCHEMBL23141177 0.77 WDR5 (0.54) HCRTR1G6PDKEAP1HKDC1
SCHEMBL829858 0.74 ALDH1A1 (0.46) NCEH1LMNAALDH1A1NPC1RAB9A
SCHEMBL7115960 0.70 KCNJ11 (0.64) ALDH1A1GAAHSD17B10MAPT
SCHEMBL9240967 0.70 ALDH1A1 (0.49) HCRTR1G6PDLMNAALDH1A1HSD17B10
Phenanthrene SCHEMBL28164716 0.69 ALDH1A1 (0.60) HCRTR1G6PDKEAP1HKDC1ALDH1A1
SCHEMBL6938277 0.69 NCEH1 (0.52) NCEH1LMNAMTNR1AMTNR1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US claimed
EP-1828195-A2 SUBSTITUTED PHENOLS AS ACTIVE AGENTS INHIBITING VEGF PRODUCTION PTC Therapeutics, Inc. (US) 2007-09-05 EP claimed
WO-2006065479-A2 SUBSTITUTED PHENOLS AS ACTIVE AGENTS INHIBITING VEGF PRODUCTION PTC THERAPEUTICS, INC. (US) 2006-06-22 WO claimed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
EP-1828195-A2 SUBSTITUTED PHENOLS AS ACTIVE AGENTS INHIBITING VEGF PRODUCTION PTC Therapeutics, Inc. (US) 2007-09-05 EP disclosed
WO-2006065479-A2 SUBSTITUTED PHENOLS AS ACTIVE AGENTS INHIBITING VEGF PRODUCTION PTC THERAPEUTICS, INC. (US) 2006-06-22 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-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production VEGFA, FLT4, FLT1 HCRTR1 4632/4885G6PD 1215/4885KEAP1 442/4885

“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.