SCHEMBL6042557

SCHEMBL6042557

O=C(O)N1CCC(c2ccc(OCc3cc(-c4ccccc4)no3)cc2)C(O)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.53
NPC1 O15118 6/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
TDP1 Q9NUW8 3/20 0.53
MAPT P10636 2/20 0.47
POLB P06746 2/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL6956617 0.87 RAB9A (0.51) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1
SCHEMBL6043947 0.83 REN (0.50) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1
SCHEMBL6958396 0.82 RAB9A (0.45) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1
SCHEMBL3069231 0.81 NPC1 (0.52) RAB9ANPC1L3MBTL1SMN1; SMN2MAPT
SCHEMBL6042111 0.79 REN (0.45) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1
SCHEMBL6041811 0.79 RAB9A (0.42) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1
SCHEMBL6041420 0.79 MEN1 (0.53) RAB9ANPC1L3MBTL1SMN1; SMN2MAPT
SCHEMBL6043844 0.78 MEN1 (0.45) RAB9ANPC1L3MBTL1SMN1; SMN2MAPT
SCHEMBL6041847 0.77 REN (0.44) RAB9ANPC1SMN1; SMN2
SCHEMBL6042525 0.77 RAB9A (0.39) RAB9ANPC1L3MBTL1SMN1; SMN2TDP1

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 RAB9A 1698/4885NPC1 418/4885L3MBTL1 1516/4885

“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.