SCHEMBL5485310

SCHEMBL5485310

CC(C)(C)OC(=O)N1CCCC1c1cc(-c2cccc(Cl)c2)on1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.68
UCHL1 P09936 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
POLB P06746 1/20 0.49
HCRTR1 O43613 3/20 0.49
HCRTR2 O43614 3/20 0.49
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
GRM5 P41594 3/20 0.47
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL2890386 0.97 USP30 (0.64) USP30UCHL1SMN1; SMN2POLBHCRTR1
SCHEMBL2890390 0.97 USP30 (0.64) USP30UCHL1SMN1; SMN2POLBHCRTR1
Succinchlorimide SCHEMBL5800912 0.90 USP30 (0.57) USP30UCHL1SMN1; SMN2POLBHCRTR1
SCHEMBL2899277 0.89 USP30 (0.57) USP30HCRTR1HCRTR2GRM5MAPT
SCHEMBL2899271 0.89 USP30 (0.57) USP30HCRTR1HCRTR2GRM5MAPT
SCHEMBL13876923 0.89 HCRTR1 (0.57) USP30HCRTR1HCRTR2ALDH1A1MEN1
SCHEMBL17063895 0.89 HCRTR1 (0.57) USP30HCRTR1HCRTR2ALDH1A1MEN1
SCHEMBL17063898 0.89 HCRTR1 (0.57) USP30HCRTR1HCRTR2ALDH1A1MEN1
SCHEMBL5478169 0.89 USP30 (0.56) USP30UCHL1SMN1; SMN2POLBNPC1
SCHEMBL8226169 0.88 USP30 (0.56) USP30UCHL1SMN1; SMN2HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-08-09 US disclosed
EP-1716143-A1 POLYHETEROCYCLIC COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2006-11-02 EP disclosed
US-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB 2006-02-02 US disclosed
WO-2005080386-A1 POLYHETEROCYCLIC COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS ASTRAZENECA AB (US) 2005-09-01 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 (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-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 USP30 2814/4885UCHL1 4282/4885SMN1; SMN2 3066/4885
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 USP30 2830/4885UCHL1 4254/4885SMN1; SMN2 3354/4885

“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.