SCHEMBL6042443

SCHEMBL6042443

C=CCOc1ccc(C2CCN(C(=O)O)CC2OCc2ccc3ccccc3c2OCCOC)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.35
MTNR1A P48039 2/20 0.34
POLB P06746 1/20 0.33
MAPT P10636 2/20 0.32
MMP13 P45452 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
USP30 Q70CQ3 1/20 0.32
BLM P54132 1/20 0.31
P2RY12 Q9H244 1/20 0.31
HTR2A P28223 1/20 0.31
TEAD1 P28347 1/20 0.31
TEAD3 Q99594 1/20 0.31

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
SCHEMBL6042484 0.95 REN (0.33) RENMTNR1APOLBMAPTMMP13
SCHEMBL6043104 0.89 REN (0.33) REN
SCHEMBL7076917 0.86 REN (0.33) RENMTNR1ABLMHTR2A
SCHEMBL6041853 0.85 REN (0.33) REN
SCHEMBL6041417 0.84 PDCD1 (0.41) REN
SCHEMBL6042525 0.83 RAB9A (0.39) RENPOLBMAPTNPC1RAB9A
SCHEMBL6041261 0.82 REN (0.41) RENNPC1RAB9A
SCHEMBL6043107 0.81 REN (0.36) RENMMP13RAB9A
SCHEMBL6043060 0.81 REN (0.49) REN
SCHEMBL6043099 0.81 REN (0.36) RENMMP13RAB9A

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 1485/4885MTNR1A 117/4885POLB 952/4885

“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.