SCHEMBL6044182

SCHEMBL6044182

COc1cccc(C2CCN(Cc3ccccc3)CC2O)c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.56
CHRM4 P08173 1/20 0.52
SLC18A3 Q16572 2/20 0.51
MCHR1 Q99705 1/20 0.50
ACHE P22303 1/20 0.49
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.48
DRD2 P14416 1/20 0.48
GPR39 O43194 1/20 0.48

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
SCHEMBL6042108 0.88 NPC1 (0.57) KMT2AKDM4ELMNAMEN1DRD2
SCHEMBL16874602 0.86 MEN1 (0.63) SIGMAR1SLC18A3ACHEKMT2AMEN1
SCHEMBL16874797 0.86 MEN1 (0.63) SIGMAR1SLC18A3ACHEKMT2AMEN1
SCHEMBL6042122 0.86 MEN1 (0.63) SIGMAR1SLC18A3ACHEKMT2AMEN1
SCHEMBL22928142 0.85 DRD2 (0.62) SIGMAR1CHRM4MCHR1ACHEKMT2A
SCHEMBL6353029 0.85 DRD2 (0.62) SIGMAR1CHRM4MCHR1ACHEKMT2A
SCHEMBL28859467 0.83 SIGMAR1 (0.51) SIGMAR1CHRM4MCHR1ACHEKMT2A
SCHEMBL11558271 0.83 FUCA1 (0.60) SIGMAR1SLC18A3ACHEALDH1A1HTT
SCHEMBL11558275 0.83 FUCA1 (0.60) SIGMAR1SLC18A3ACHEALDH1A1HTT
SCHEMBL11558282 0.83 FUCA1 (0.60) SIGMAR1SLC18A3ACHEALDH1A1HTT

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 7 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
EP-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP 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
EP-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 SIGMAR1 3885/4885CHRM4 129/4885SLC18A3 400/4885

“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.