SCHEMBL1032633

SCHEMBL1032633

CC(C)(C)OC(=O)N1CCC(Oc2cccc(N)c2)C1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.56
KDM1A O60341 1/20 0.51
GPR119 Q8TDV5 6/20 0.49
CHEK2 O96017 2/20 0.48
PIK3CD O00329 4/20 0.47
NR1H2 P55055 1/20 0.46
PDE4B Q07343 1/20 0.46
PIK3CA P42336 2/20 0.46
PIK3CB P42338 2/20 0.46
PIK3CG P48736 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 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
SCHEMBL8248136 1.00 USP30 (0.56) USP30KDM1AGPR119CHEK2PIK3CD
SCHEMBL28059314 1.00 USP30 (0.56) USP30KDM1AGPR119CHEK2PIK3CD
SCHEMBL28826952 0.93 CHEK2 (0.55) USP30KDM1AGPR119CHEK2NR1H2
SCHEMBL29796027 0.93 KDM1A (0.58) USP30KDM1AGPR119CHEK2NR1H2
SCHEMBL520668 0.93 KDM1A (0.58) USP30KDM1AGPR119CHEK2NR1H2
SCHEMBL12184833 0.90 USP30 (0.52) USP30KDM1AGPR119CHEK2NR1H2
SCHEMBL9900538 0.88 GPR119 (0.57) USP30KDM1AGPR119PIK3CDPDE4B
SCHEMBL15637939 0.87 USP30 (0.55) USP30KDM1AGPR119PIK3CDPDE4B
SCHEMBL9901530 0.87 USP30 (0.58) USP30KDM1AGPR119PIK3CDMEN1
SCHEMBL29577158 0.87 USP30 (0.55) USP30KDM1AGPR119PIK3CDPDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2273992-B1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2016-05-25 EP disclosed
US-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2011-02-24 US disclosed
US-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2011-02-24 US disclosed
EP-2273992-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS Sirtris Pharmaceuticals, Inc. (US) 2011-01-19 EP disclosed
WO-2009134973-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2009-11-05 WO disclosed
WO-2009134973-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2009-11-05 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-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRT3, SIRT1, SIRT2 USP30 1179/4885KDM1A 1199/4885GPR119 156/4885

“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.