SCHEMBL7952964

SCHEMBL7952964

[CH2]COC(=O)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 5/20 0.59
SCN1A P35498 2/20 0.57
SCN2A Q99250 2/20 0.57
SCN3A Q9NY46 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
TSHR P16473 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2D6 P10635 2/20 0.54
THPO P40225 2/20 0.54
MTOR P42345 2/20 0.54
USP2 O75604 1/20 0.54
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
MAPK1 P28482 3/20 0.52
LMNA P02545 2/20 0.52
PMP22 Q01453 2/20 0.52
HTT P42858 1/20 0.52
ABCC4 O15439 1/20 0.52
CYP2C9 P11712 1/20 0.52

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
SCHEMBL7956551 0.86 SLC29A1 (0.64) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL9653043 0.86 KMT2A (0.53) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
Ethyltrimethoxy Benzoate SCHEMBL4410910 0.84 KMT2A (0.66) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL7952952 0.83 SCN1A (0.68) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL7635612 0.83 KMT2A (0.50) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL7956555 0.82 SLC29A1 (0.67) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL10428055 0.82 SLC29A1 (0.59) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL10887449 0.82 SLC29A1 (0.59) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL10428390 0.82 SLC29A1 (0.59) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL9419914 0.81 SLC29A1 (0.55) SLC29A1SCN1ASCN2ASCN3ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150119346-A1 GLYCOSYLATED VALPROIC ACID ANALOGS AND USES THEREOF Chromatin Technologies 2015-04-30 US disclosed
US-8921533-B2 Glycosylated valproic acid analogs and uses thereof Chromatin Technologies (US) 2014-12-30 US disclosed
US-20130029924-A1 GLYCOSYLATED VALPROIC ACID ANALOGS AND USES THEREOF Chromatin Technologies (US) 2013-01-31 US disclosed
US-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed
EP-0508549-B1 New triazolopyrimidine and pyrazolopyrimidine derivatives useful for treating cachexia SANKYO CO (JP) 1995-04-26 EP disclosed
EP-0347252-B1 METHOD OF TREATING CACHEXIA AND CERTAIN NEW COMPOUNDS FOR USE IN THIS METHOD SANKYO COMPANY LIMITED (JP) 1993-05-05 EP disclosed
US-5162573-A Anticonvulsant, antiepileptic agent CHIESI FARMACEUTICI S.P.A. (IT) 1992-11-10 US disclosed
EP-0508549-A2 New triazolopyrimidine and pyrazolopyrimidine derivatives useful for treating cachexia SANKYO COMPANY LIMITED (JP) 1992-10-14 EP disclosed
EP-0250997-B1 VALPROIC AND (E)-2-VALPROENOIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREFROM CHIESI FARMACEUTICI S.p.A. (IT) 1992-04-15 EP disclosed
US-5086057-A METHOD OF TREATING CACHEXIA AND CERTAIN NEW COMPOUNDS FOR USE IN THIS METHOD SANKYO COMPANY LIMITED (JP) 1992-02-04 US disclosed
US-5055479-A For enhancing activity of lipoprotein lipase enzymes SANKYO COMPANY, LIMITED (JP) 1991-10-08 US disclosed
EP-0250997-A2 Valproic and (E)-2-valproenoic acid derivatives, processes for the preparation thereof and pharmaceutical compositions therefrom CHIESI FARMACEUTICI S.p.A. (IT) 1988-01-07 EP disclosed
US-3985881-A 1(3,4,5-Trimethoxybenzamido methyl) tetrahydro isoquinoline derivatives and a process for their production MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-10-12 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-20130029924-A1 GLYCOSYLATED VALPROIC ACID ANALOGS AND USES THEREOF HDAC3, VGF, HDAC1 SLC29A1 1507/4885SCN1A 474/4885SCN2A 315/4885
US-20150119346-A1 GLYCOSYLATED VALPROIC ACID ANALOGS AND USES THEREOF HDAC3, VGF, HDAC1 SLC29A1 1507/4885SCN1A 474/4885SCN2A 315/4885

“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.