SCHEMBL6042456

SCHEMBL6042456

COc1cccc(C(=O)OCc2ccc(C3CCN(C(=O)O)CC3OCc3ccc4ccccc4c3OCOCC[Si](C)(C)C)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.48
DGAT1 O75907 3/20 0.35
MCHR1 Q99705 2/20 0.34
CCR5 P51681 1/20 0.33
F2R P25116 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
MITF O75030 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL7081179 0.89 REN (0.46) RENDGAT1MCHR1DRD2DRD4
SCHEMBL6042683 0.86 REN (0.34) REN
SCHEMBL6043265 0.84 SMN1; SMN2 (0.33) RENHTTRAB9A
SCHEMBL6042320 0.83 REN (0.32) REN
SCHEMBL6043344 0.82 REN (0.53) REN
SCHEMBL7569542 0.81 REN (0.48) RENDGAT1MCHR1CCR5NPSR1
SCHEMBL6041487 0.81 REN (0.70) RENMCHR1CCR5
SCHEMBL6041322 0.78 REN (0.40) RENRAB9A
SCHEMBL6041853 0.78 REN (0.33) REN
SCHEMBL6042404 0.77 REN (0.58) REN

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 REN 1485/4885DGAT1 3762/4885MCHR1 3054/4885

“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.