SCHEMBL6042688

SCHEMBL6042688

O=C(O)N1CCC(c2ccccn2)C(O)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.43
HSD11B1 P28845 1/20 0.43
SPR P35270 1/20 0.41
SLC6A9 P48067 1/20 0.41
KDM5A P29375 1/20 0.40
SCD5 Q86SK9 2/20 0.39
EPHX2 P34913 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
NAMPT P43490 1/20 0.37

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
SCHEMBL2806341 0.81 HSD11B1 (0.60) USP30HSD11B1SPRKDM5ASCD5
SCHEMBL6955166 0.80 USP30 (0.36) USP30HSD11B1SPRSLC6A9KDM5A
SCHEMBL6042250 0.79 SLC18A3 (0.55) EPHX2SIGMAR1
SCHEMBL2241229 0.79 SLC18A3 (0.55) EPHX2SIGMAR1
SCHEMBL2241225 0.79 SLC18A3 (0.55) EPHX2SIGMAR1
SCHEMBL16554291 0.78 HMOX1 (0.37) L3MBTL1CYP3A4CYP2C9
SCHEMBL4074303 0.78 HSD11B1 (0.53) USP30HSD11B1SPRKDM5ASCD5
SCHEMBL6347014 0.77 HSD11B1 (0.53) USP30HSD11B1SPRKDM5APRMT5
SCHEMBL15103147 0.76 DDB1 (0.44) EPHX2L3MBTL1
SCHEMBL15103148 0.76 DDB1 (0.44) EPHX2L3MBTL1

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-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 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 (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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 USP30 1066/4885HSD11B1 1520/4885SPR 1208/4885

“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.