SCHEMBL6043826

SCHEMBL6043826

O=C(O)N1CCC(Oc2ccccc2)C(O)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 2/20 0.46
CTSL P07711 2/20 0.46
CTSB P07858 2/20 0.46
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
CTSC P53634 2/20 0.46
CTSH P09668 1/20 0.46
CTSF Q9UBX1 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.43
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GRM5 P41594 1/20 0.40
TEAD1 P28347 1/20 0.39
TEAD3 Q99594 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL19023044 0.83 MGLL (0.50) EPHX2
SCHEMBL408174 0.83 USP30 (0.58) KDM4EALDH1A1USP30
SCHEMBL19041868 0.83 USP30 (0.58) KDM4EALDH1A1USP30
SCHEMBL19037361 0.83 USP30 (0.58) KDM4EALDH1A1USP30
SCHEMBL11238378 0.82 SMN1; SMN2 (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL6954138 0.82 SMN1; SMN2 (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11238381 0.82 SMN1; SMN2 (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2532124 0.80 EPHX2 (0.53) GAAEPHX2SCD5SRD5A1USP30
SCHEMBL796858 0.80 EPHX2 (0.53) GAAEPHX2SCD5SRD5A1USP30
SCHEMBL796833 0.80 EPHX2 (0.53) GAAEPHX2SCD5SRD5A1USP30

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 CTSV 168/4885CTSL 180/4885CTSB 35/4885

“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.