SCHEMBL6041704

SCHEMBL6041704

O=C(O)N1CCC(c2ccc(F)cc2)C(OCc2cc(OCc3cccnc3)c3ccccc3c2)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
MAPT P10636 1/20 0.42
MGLL Q99685 1/20 0.41
LRRK2 Q5S007 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GRM4 Q14833 1/20 0.39
REN P00797 1/20 0.39
SGMS2 Q8NHU3 2/20 0.38
FPR1 P21462 1/20 0.38
FPR2 P25090 1/20 0.38
TACR1 P25103 2/20 0.38
MET P08581 1/20 0.37
PRKDC P78527 2/20 0.37
KRAS P01116 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
SCHEMBL6044005 0.92 KDM2B (0.40) MAPTNPC1RAB9AREN
SCHEMBL6042212 0.91 MGLL (0.39) MAPTMGLLLRRK2CYP11B1CYP11B2
SCHEMBL6041832 0.88 REN (0.39) MAPTNPC1RAB9ARENFPR1
SCHEMBL6041290 0.88 REN (0.39) MAPTNPC1RAB9ARENKRAS
SCHEMBL6042261 0.86 CCR3 (0.37) MAPTNPC1RAB9AREN
SCHEMBL6043273 0.85 REN (0.42) MAPTLRRK2NPC1RAB9AREN
SCHEMBL6042512 0.85 REN (0.42) REN
SCHEMBL6042864 0.85 REN (0.45) NPC1RAB9AREN
SCHEMBL6043330 0.85 KDM2B (0.36) MAPTNPC1RAB9AREN
SCHEMBL6042154 0.85 REN (0.39) MAPTRAB9AREN

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
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
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 HTT 155/4885MAPT 43/4885MGLL 1480/4885

“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.