SCHEMBL4226480

SCHEMBL4226480

CC(C)(C)OC(=O)N1CCCC(c2noc(-c3ccc(F)cc3F)n2)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
TRPV3 Q8NET8 1/20 0.44
ACKR3 P25106 3/20 0.43
KCNH2 Q12809 1/20 0.43
BCL9 O00512 1/20 0.43
CTNNB1 P35222 1/20 0.43
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
HSD11B1 P28845 1/20 0.42
HPGDS O60760 1/20 0.41
NPSR1 Q6W5P4 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
SCHEMBL10040508 0.90 SMN1; SMN2 (0.53) USP30SMN1; SMN2LMNA
SCHEMBL4226960 0.89 USP30 (0.52) USP30SMN1; SMN2TRPV3ALOX5APFEN1
SCHEMBL4223141 0.87 USP30 (0.53) USP30TRPV3MEN1KMT2AHDAC4
SCHEMBL4223144 0.87 USP30 (0.53) USP30TRPV3MEN1KMT2AHDAC4
SCHEMBL4231271 0.87 USP30 (0.53) USP30TRPV3MEN1KMT2AHDAC4
SCHEMBL4227295 0.83 USP30 (0.49) USP30SMN1; SMN2TRPV3ALOX5APFEN1
SCHEMBL193379 0.83 MEN1 (0.58) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL4227292 0.83 USP30 (0.49) USP30SMN1; SMN2TRPV3ALOX5APFEN1
SCHEMBL193380 0.83 MEN1 (0.58) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL4223992 0.83 GRM5 (0.57) SMN1; SMN2ACKR3KCNH2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215822-A1 Substituted Oxadiazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate Receptors NIKEM RESEARCH SRL (IT) 2009-08-27 US disclosed
EP-1893606-A2 SUBSTITUTED OXADIAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2008-03-05 EP disclosed
WO-2006123255-A2 SUBSTITUTED OXADIAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-11-23 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-20090215822-A1 Substituted Oxadiazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate Receptors GRM5, GRM3, GRM2 USP30 1767/4885SMN1; SMN2 1069/4885TRPV3 267/4885

“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.